2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide

C15H14N4O — CID 107337812

IUPAC2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide
SMILESN#CCc1ccc(NC(=O)Cc2ccc(N)cn2)cc1
InChIInChI=1S/C15H14N4O/c16-8-7-11-1-4-13(5-2-11)19-15(20)9-14-6-3-12(17)10-18-14/h1-6,10H,7,9,17H2,(H,19,20)
InChIKeyPYDKDWNSJBFJPF-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.91
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide

2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide (PubChem CID 107337812) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide
PubChem CID107337812
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide
SMILESN#CCc1ccc(NC(=O)Cc2ccc(N)cn2)cc1
InChIInChI=1S/C15H14N4O/c16-8-7-11-1-4-13(5-2-11)19-15(20)9-14-6-3-12(17)10-18-14/h1-6,10H,7,9,17H2,(H,19,20)
InChIKeyPYDKDWNSJBFJPF-UHFFFAOYSA-N
XLogP1.91
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-2-(5-amino-2-pyridinyl)acetamide
CID 107337507
2-[(5-amino-2-pyridinyl)sulfanyl]-N-[4-(cyanomethyl)phenyl]acetamide
CID 43300974
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]benzoic acid
CID 107338179
2-(5-amino-2-pyridinyl)-N-(4-propan-2-ylphenyl)acetamide
CID 107337408
2-(5-amino-2-pyridinyl)-N-(3,4-dichlorophenyl)acetamide
CID 107337411
2-(5-amino-2-pyridinyl)-N-(6-fluoro-3-pyridinyl)acetamide
CID 114052733
3-(4-aminophenyl)-N-[4-(cyanomethyl)phenyl]propanamide
CID 62302853
2-(4-acetamidophenyl)-N-[4-(cyanomethyl)phenyl]acetamide
CID 26375554
N-[4-(cyanomethyl)phenyl]-2-phenylacetamide
CID 674697
2-[5-[[2-(4-aminophenyl)acetyl]amino]-2-pyridinyl]acetic acid
CID 107340926
2-(5-amino-2-pyridinyl)-N-(3,5-difluorophenyl)acetamide
CID 107337468
2-(5-amino-2-pyridinyl)-N-(3,4,5-trifluorophenyl)acetamide
CID 107338694

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide (CID 107337812) is 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide is N#CCc1ccc(NC(=O)Cc2ccc(N)cn2)cc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide?
The InChIKey is PYDKDWNSJBFJPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c16-8-7-11-1-4-13(5-2-11)19-15(20)9-14-6-3-12(17)10-18-14/h1-6,10H,7,9,17H2,(H,19,20).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide?
2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide has a molecular weight of 266.30 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[4-(cyanomethyl)phenyl]acetamide is sourced from PubChem (CID 107337812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).