5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide

C17H27N3O — CID 82014227

IUPAC5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide
SMILESCC(CN)CCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-14(13-18)9-10-17(21)19-15-7-3-4-8-16(15)20-11-5-2-6-12-20/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3,(H,19,21)
InChIKeyPIKLXBDOCHTFFP-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.99
Rot. Bonds6

About 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide

5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide (PubChem CID 82014227) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide.

Molecular Properties

Compound Name5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide
PubChem CID82014227
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide
SMILESCC(CN)CCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C17H27N3O/c1-14(13-18)9-10-17(21)19-15-7-3-4-8-16(15)20-11-5-2-6-12-20/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3,(H,19,21)
InChIKeyPIKLXBDOCHTFFP-UHFFFAOYSA-N
XLogP2.99
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119842100
5-amino-N-(2-piperidin-1-ylphenyl)hexanamide
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2-amino-N-(2-piperidin-1-ylphenyl)acetamide;dihydrochloride
CID 119828044
N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
5-amino-4-methyl-N-(2-methyl-4-pyrrolidin-1-ylphenyl)pentanamide
CID 82013453
5-hydroxy-N-(2-piperidin-1-ylphenyl)pentanamide
CID 79199095
5-chloro-N-(2-piperidin-1-ylphenyl)pentanamide
CID 43167914
5-amino-4-methyl-N-[2-(tetrazol-1-yl)phenyl]pentanamide
CID 82011021
2-(3-methylbutylamino)-N-(2-piperidin-1-ylphenyl)acetamide;oxalic acid
CID 171668727
2-(4-aminophenyl)-N-[2-(azepan-1-yl)phenyl]acetamide
CID 119842058
N-[2-(azepan-1-yl)phenyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 38282948
2-amino-N-(2-pyrrolidin-1-ylphenyl)propanamide;hydrochloride
CID 119164504

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide?
The IUPAC name of 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide (CID 82014227) is 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide.
What is the SMILES notation for 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide?
The canonical SMILES for 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide is CC(CN)CCC(=O)Nc1ccccc1N1CCCCC1.
What is the InChIKey of 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide?
The InChIKey is PIKLXBDOCHTFFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-14(13-18)9-10-17(21)19-15-7-3-4-8-16(15)20-11-5-2-6-12-20/h3-4,7-8,14H,2,5-6,9-13,18H2,1H3,(H,19,21).
What are the key properties of 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide?
5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide has a molecular weight of 289.42 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-methyl-N-(2-piperidin-1-ylphenyl)pentanamide is sourced from PubChem (CID 82014227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).