2-amino-N-(5-piperidin-1-ylpentyl)benzamide

C17H27N3O — CID 119947207

IUPAC2-amino-N-(5-piperidin-1-ylpentyl)benzamide
SMILESNc1ccccc1C(=O)NCCCCCN1CCCCC1
InChIInChI=1S/C17H27N3O/c18-16-10-4-3-9-15(16)17(21)19-11-5-1-6-12-20-13-7-2-8-14-20/h3-4,9-10H,1-2,5-8,11-14,18H2,(H,19,21)
InChIKeyNRJPGKOWVHZXQG-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.65
Rot. Bonds7

About 2-amino-N-(5-piperidin-1-ylpentyl)benzamide

2-amino-N-(5-piperidin-1-ylpentyl)benzamide (PubChem CID 119947207) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-amino-N-(5-piperidin-1-ylpentyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(5-piperidin-1-ylpentyl)benzamide
PubChem CID119947207
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-amino-N-(5-piperidin-1-ylpentyl)benzamide
SMILESNc1ccccc1C(=O)NCCCCCN1CCCCC1
InChIInChI=1S/C17H27N3O/c18-16-10-4-3-9-15(16)17(21)19-11-5-1-6-12-20-13-7-2-8-14-20/h3-4,9-10H,1-2,5-8,11-14,18H2,(H,19,21)
InChIKeyNRJPGKOWVHZXQG-UHFFFAOYSA-N
XLogP2.65
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
CID 61249597
1-(2-aminophenyl)-6-piperidin-1-ylhexan-1-one
CID 54276686
2-amino-N-[4-(2-methylpiperidin-1-yl)butyl]benzamide
CID 119946610
3-amino-2-chloro-N-(2-piperidin-1-ylethyl)benzamide
CID 112575773
2-amino-N-[4-(2,6-dimethylmorpholin-4-yl)butyl]benzamide
CID 119946742
2-ethoxy-N-(7-pyrrolidin-1-ylheptyl)benzamide
CID 47074532
2-amino-N-dodecylbenzamide
CID 54099396
2-amino-4-bromo-N-(2-piperidin-1-ylethyl)benzamide
CID 79723555
2,5-dichloro-N-(5-piperidin-1-ylpentyl)benzamide
CID 110440779
1-methyl-N-(5-piperidin-1-ylpentyl)indazole-3-carboxamide
CID 54486483
2-amino-N-[4-[4-(2,1-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide;hydrochloride
CID 67835617
2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide
CID 10501784

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-piperidin-1-ylpentyl)benzamide?
The IUPAC name of 2-amino-N-(5-piperidin-1-ylpentyl)benzamide (CID 119947207) is 2-amino-N-(5-piperidin-1-ylpentyl)benzamide.
What is the SMILES notation for 2-amino-N-(5-piperidin-1-ylpentyl)benzamide?
The canonical SMILES for 2-amino-N-(5-piperidin-1-ylpentyl)benzamide is Nc1ccccc1C(=O)NCCCCCN1CCCCC1.
What is the InChIKey of 2-amino-N-(5-piperidin-1-ylpentyl)benzamide?
The InChIKey is NRJPGKOWVHZXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c18-16-10-4-3-9-15(16)17(21)19-11-5-1-6-12-20-13-7-2-8-14-20/h3-4,9-10H,1-2,5-8,11-14,18H2,(H,19,21).
What are the key properties of 2-amino-N-(5-piperidin-1-ylpentyl)benzamide?
2-amino-N-(5-piperidin-1-ylpentyl)benzamide has a molecular weight of 289.42 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-piperidin-1-ylpentyl)benzamide is sourced from PubChem (CID 119947207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).