N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide

C19H17N3O — CID 95935601

IUPACN-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide
SMILESC[C@@H](NC(=O)c1cccnc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C19H17N3O/c1-14(22-19(23)18-3-2-10-21-13-18)15-4-6-16(7-5-15)17-8-11-20-12-9-17/h2-14H,1H3,(H,22,23)/t14-/m1/s1
InChIKeyLKDWQINIMJFLEE-CQSZACIVSA-N
MW303.37 g/mol
LogP3.63
Rot. Bonds4

About N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide

N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 95935601) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide
PubChem CID95935601
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide
SMILESC[C@@H](NC(=O)c1cccnc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C19H17N3O/c1-14(22-19(23)18-3-2-10-21-13-18)15-4-6-16(7-5-15)17-8-11-20-12-9-17/h2-14H,1H3,(H,22,23)/t14-/m1/s1
InChIKeyLKDWQINIMJFLEE-CQSZACIVSA-N
XLogP3.63
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 4126174
1-methyl-N-[1-(4-pyridin-4-ylphenyl)ethyl]pyrazole-4-carboxamide
CID 71983829
N-[1-(3,5-difluorophenyl)ethyl]pyridine-3-carboxamide
CID 140591732
N-(1-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 51073131
N-[3-[[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]carbamoyl]phenyl]pyridine-3-carboxamide
CID 51940025
N-[(1R)-1-phenylethyl]pyridine-4-carboxamide
CID 730033
2-(methylamino)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
CID 120704866
N-[2-oxo-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 166223531
4-propan-2-yl-N-(1-pyridin-4-ylethyl)benzamide
CID 17330741
4-benzoyl-N-[(1R)-1-pyridin-4-ylethyl]benzamide
CID 40513318
N-[(4-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 51151137
N-[1-(2,4,5-trimethylphenyl)ethyl]pyridine-3-carboxamide
CID 133220444

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide (CID 95935601) is N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide is C[C@@H](NC(=O)c1cccnc1)c1ccc(-c2ccncc2)cc1.
What is the InChIKey of N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is LKDWQINIMJFLEE-CQSZACIVSA-N. The full InChI is InChI=1S/C19H17N3O/c1-14(22-19(23)18-3-2-10-21-13-18)15-4-6-16(7-5-15)17-8-11-20-12-9-17/h2-14H,1H3,(H,22,23)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide?
N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 95935601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).