4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide

C20H29N3O2 — CID 46700387

IUPAC4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide
SMILESO=C(CCC1CCCC1)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C20H29N3O2/c24-19(11-10-16-6-4-5-7-16)21-18-12-14-23(15-13-18)20(25)22-17-8-2-1-3-9-17/h1-3,8-9,16,18H,4-7,10-15H2,(H,21,24)(H,22,25)
InChIKeyGKLVZZCWGOFRQA-UHFFFAOYSA-N
MW343.47 g/mol
LogP3.77
Rot. Bonds5

About 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide

4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide (PubChem CID 46700387) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide
PubChem CID46700387
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide
SMILESO=C(CCC1CCCC1)NC1CCN(C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C20H29N3O2/c24-19(11-10-16-6-4-5-7-16)21-18-12-14-23(15-13-18)20(25)22-17-8-2-1-3-9-17/h1-3,8-9,16,18H,4-7,10-15H2,(H,21,24)(H,22,25)
InChIKeyGKLVZZCWGOFRQA-UHFFFAOYSA-N
XLogP3.77
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(7-aminoheptanoylamino)-N-phenylpiperidine-1-carboxamide
CID 119700221
4-(4-phenoxybutanoylamino)-N-phenylpiperidine-1-carboxamide
CID 51324376
3-[3-(cyclopentylamino)-3-oxopropyl]-N-(4-fluorophenyl)piperidine-1-carboxamide
CID 53138057
3-[3-(cycloheptylamino)-3-oxopropyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 53138024
(3R)-3-[3-(cyclohexylamino)-3-oxopropyl]-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 95094005
N-phenyl-4-[(2-prop-2-enylsulfanylacetyl)amino]piperidine-1-carboxamide
CID 51088852
4-[(2-naphthalen-2-ylacetyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324367
4-[3-(2,4-dimethylphenyl)propanoylamino]-N-phenylpiperidine-1-carboxamide
CID 51324491
3-cyclohexyl-N-[1-[2-(1,3-dioxoisoindol-2-yl)acetyl]piperidin-4-yl]propanamide
CID 108555684
4-[3-(4-methyl-1,2,4-triazol-3-yl)propanoylamino]-N-phenylpiperidine-1-carboxamide
CID 77091525
(3R)-3-[3-(benzylamino)-3-oxopropyl]-N-phenylpiperidine-1-carboxamide
CID 95094068
4-(pentanoylamino)-N-(4-phenoxyphenyl)piperidine-1-carboxamide
CID 127145242

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide (CID 46700387) is 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide is O=C(CCC1CCCC1)NC1CCN(C(=O)Nc2ccccc2)CC1.
What is the InChIKey of 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide?
The InChIKey is GKLVZZCWGOFRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c24-19(11-10-16-6-4-5-7-16)21-18-12-14-23(15-13-18)20(25)22-17-8-2-1-3-9-17/h1-3,8-9,16,18H,4-7,10-15H2,(H,21,24)(H,22,25).
What are the key properties of 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide?
4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 3.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylpropanoylamino)-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 46700387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).