CAS
913836-26-7 Purity
98%
913836-26-7 Purity
98%
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2-Pyridinecarboxamide,N-(phenylmethyl)-4-[(phenylmethyl)amino]-
CAS
913836-29-0
Catalog Number
ACM913836290
Category
Other Products
Molecular Weight
317.38436
Molecular Formula
C20H19N3O
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Specification
Synonyms
N-Benzyl-4-(benzylamino)picolinamide, 913836-29-0, ACMC-209rb7, CTK5G9475, MolPort-001-768-351, ANW-39665, OR3773, ZINC12471980, AKOS015839378, N-Benzyl-4-(benzylamino)picolinamide,, AG-H-74999, AK-92729, BD230635, KB-57711, 4-(Benzylamino)-N-benzylpyridine-2-carboxamide, B-4098, N-benzyl-4-(benzylamino)pyridine-2-carboxamide, I01-11373
IUPAC Name
N-benzyl-4-(benzylamino)pyridine-2-carboxamide
Canonical SMILES
C1=CC=C(C=C1)CNC2=CC(=NC=C2)C(=O)NCC3=CC=CC=C3
InChI Key
FUROWHQALJOYFF-UHFFFAOYSA-N
Boiling Point
556.5ºC at 760 mmHg
Flash Point
290.3ºC
Density
1.202g/cm³
Exact Mass
317.15300
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of the compound with PubChem CID 25307243?
The molecular formula is C20H19N3O.
What is the molecular weight of the compound?
The molecular weight is 317.4 g/mol.
What is the IUPAC Name of the compound?
The IUPAC Name is N-benzyl-4-(benzylamino)pyridine-2-carboxamide.
What is the InChIKey of the compound?
The InChIKey is FUROWHQALJOYFF-UHFFFAOYSA-N.
How many hydrogen bond donor counts are there in the compound?
There are 2 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.4.
What is the exact mass of the compound?
The exact mass is 317.152812238 g/mol.
How many rotatable bond counts are there in the compound?
There are 6 rotatable bond counts.
How many hydrogen bond acceptor counts are there in the compound?
There are 3 hydrogen bond acceptor counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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