N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide

C15H15N3O2 — CID 175723689

IUPACN-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)CCc1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O2/c16-14(19)9-6-11-4-7-12(8-5-11)18-15(20)13-3-1-2-10-17-13/h1-5,7-8,10H,6,9H2,(H2,16,19)(H,18,20)
InChIKeyHFNNXFMTLWVAAL-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.75
Rot. Bonds5

About N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide

N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide (PubChem CID 175723689) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide
PubChem CID175723689
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide
SMILESNC(=O)CCc1ccc(NC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O2/c16-14(19)9-6-11-4-7-12(8-5-11)18-15(20)13-3-1-2-10-17-13/h1-5,7-8,10H,6,9H2,(H2,16,19)(H,18,20)
InChIKeyHFNNXFMTLWVAAL-UHFFFAOYSA-N
XLogP1.75
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 61223962
N-[4-(2-chloroethyl)phenyl]pyridine-2-carboxamide
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N-[4-(ethylaminomethyl)phenyl]pyridine-2-carboxamide
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4-(pyridine-2-carbonylamino)benzoic acid
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N-[4-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]phenyl]pyridine-2-carboxamide;dihydrochloride
CID 18319731
N-(4-pyridin-2-ylphenyl)pyridine-2-carboxamide
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N-(4-benzoylphenyl)pyridine-2-carboxamide
CID 157248993
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
dichloromanganese;bis(N-(4-methylphenyl)pyridine-2-carboxamide)
CID 11455628
N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
CID 108743925
N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 35275358
N-[4-[(N'-nitrocarbamimidoyl)amino]phenyl]pyridine-2-carboxamide
CID 135517979

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide (CID 175723689) is N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide is NC(=O)CCc1ccc(NC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide?
The InChIKey is HFNNXFMTLWVAAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-14(19)9-6-11-4-7-12(8-5-11)18-15(20)13-3-1-2-10-17-13/h1-5,7-8,10H,6,9H2,(H2,16,19)(H,18,20).
What are the key properties of N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide?
N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-amino-3-oxopropyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 175723689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).