2-(pentanoylamino)-N-pyridin-3-ylbenzamide

C17H19N3O2 — CID 30336770

IUPAC2-(pentanoylamino)-N-pyridin-3-ylbenzamide
SMILESCCCCC(=O)Nc1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C17H19N3O2/c1-2-3-10-16(21)20-15-9-5-4-8-14(15)17(22)19-13-7-6-11-18-12-13/h4-9,11-12H,2-3,10H2,1H3,(H,19,22)(H,20,21)
InChIKeyMBEYIQRXNBCPNT-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.46
Rot. Bonds6

About 2-(pentanoylamino)-N-pyridin-3-ylbenzamide

2-(pentanoylamino)-N-pyridin-3-ylbenzamide (PubChem CID 30336770) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-(pentanoylamino)-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-(pentanoylamino)-N-pyridin-3-ylbenzamide
PubChem CID30336770
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name2-(pentanoylamino)-N-pyridin-3-ylbenzamide
SMILESCCCCC(=O)Nc1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C17H19N3O2/c1-2-3-10-16(21)20-15-9-5-4-8-14(15)17(22)19-13-7-6-11-18-12-13/h4-9,11-12H,2-3,10H2,1H3,(H,19,22)(H,20,21)
InChIKeyMBEYIQRXNBCPNT-UHFFFAOYSA-N
XLogP3.46
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methoxyacetyl)amino]-N-pyridin-3-ylbenzamide
CID 30337604
2-(butanoylamino)-N-phenylbenzamide
CID 676008
2-benzamido-N-pyridin-3-ylbenzamide
CID 730923
2-[(2-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide
CID 30334935
2-[[2-(4-bromophenoxy)acetyl]amino]-N-pyridin-3-ylbenzamide
CID 30335928
2-chloro-N-[2-(pyridin-3-ylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 30336522
4-[[2-(tetradecanoylamino)benzoyl]amino]benzoic acid
CID 155548580
N,N'-bis[2-(butylcarbamoyl)phenyl]hexanediamide
CID 17149668
N-(2-methylpropyl)-2-(pentanoylamino)benzamide
CID 34734618
N-methyl-2-(3-pyridin-3-ylpropanoylamino)benzamide
CID 34754830
2-[(2-nonylphenyl)methoxy]-N-pyridin-3-ylbenzamide
CID 118911692
2-(4-carbamoylanilino)-N-pyridin-3-ylbenzamide
CID 163309934

Frequently Asked Questions

What is the IUPAC name of 2-(pentanoylamino)-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-(pentanoylamino)-N-pyridin-3-ylbenzamide (CID 30336770) is 2-(pentanoylamino)-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-(pentanoylamino)-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-(pentanoylamino)-N-pyridin-3-ylbenzamide is CCCCC(=O)Nc1ccccc1C(=O)Nc1cccnc1.
What is the InChIKey of 2-(pentanoylamino)-N-pyridin-3-ylbenzamide?
The InChIKey is MBEYIQRXNBCPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-2-3-10-16(21)20-15-9-5-4-8-14(15)17(22)19-13-7-6-11-18-12-13/h4-9,11-12H,2-3,10H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 2-(pentanoylamino)-N-pyridin-3-ylbenzamide?
2-(pentanoylamino)-N-pyridin-3-ylbenzamide has a molecular weight of 297.36 g/mol, XLogP of 3.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pentanoylamino)-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 30336770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).