N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide

C15H16N4O2 — CID 645135

IUPACN-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide
SMILESCCCC(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
InChIInChI=1S/C15H16N4O2/c1-2-5-14(20)19-13-8-7-11(10-17-13)18-15(21)12-6-3-4-9-16-12/h3-4,6-10H,2,5H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyPSTPXKMQLYFSBH-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.47
Rot. Bonds5

About N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide

N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide (PubChem CID 645135) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide
PubChem CID645135
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC NameN-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide
SMILESCCCC(=O)Nc1ccc(NC(=O)c2ccccn2)cn1
InChIInChI=1S/C15H16N4O2/c1-2-5-14(20)19-13-8-7-11(10-17-13)18-15(21)12-6-3-4-9-16-12/h3-4,6-10H,2,5H2,1H3,(H,18,21)(H,17,19,20)
InChIKeyPSTPXKMQLYFSBH-UHFFFAOYSA-N
XLogP2.47
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

11-(2-(2-((Diethylamino)methyl)-1-piperidinyl)acetyl)-5,11-dihydro-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one
CID 107867
Pirenzepine
CID 4848
N,N'-Bis(2-pyridyl)oxalamide
CID 1927420
N11-Ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453308
N11-Isopropyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453313
4,N11-Diethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453335
2-Cyclopropyl-5,7-dimethyl-2,4,9,15-tetraazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
CID 463134
Dipyridodiazepinone deriv. 8
CID 463137
Dipyridodiazepinone deriv. 5
CID 463543
N-(pyrazin-2-yl)pyridine-4-carboxamide
CID 1247097
2,N5-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453325
2,3-Dimethyl-N11-ethyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453340

Frequently Asked Questions

What is the IUPAC name of N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The IUPAC name of N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide (CID 645135) is N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The canonical SMILES for N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide is CCCC(=O)Nc1ccc(NC(=O)c2ccccn2)cn1.
What is the InChIKey of N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
The InChIKey is PSTPXKMQLYFSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-2-5-14(20)19-13-8-7-11(10-17-13)18-15(21)12-6-3-4-9-16-12/h3-4,6-10H,2,5H2,1H3,(H,18,21)(H,17,19,20).
What are the key properties of N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide?
N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(butanoylamino)-3-pyridinyl]pyridine-2-carboxamide is sourced from PubChem (CID 645135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).