4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride

C13H25ClN2O — CID 119454408

IUPAC4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCC1CCCC1)NC1CCNC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(15-12-8-9-14-10-12)7-3-6-11-4-1-2-5-11;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyPZWOBDKYCUTSAR-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.25
Rot. Bonds5

About 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride

4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride (PubChem CID 119454408) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride.

Molecular Properties

Compound Name4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
PubChem CID119454408
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC Name4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
SMILESCl.O=C(CCCC1CCCC1)NC1CCNC1
InChIInChI=1S/C13H24N2O.ClH/c16-13(15-12-8-9-14-10-12)7-3-6-11-4-1-2-5-11;/h11-12,14H,1-10H2,(H,15,16);1H
InChIKeyPZWOBDKYCUTSAR-UHFFFAOYSA-N
XLogP2.25
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.81
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 60778008
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2-cyclobutyl-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 103165051
N-[(3S)-pyrrolidin-3-yl]decanamide
CID 79688087
N-ethyl-N'-piperidin-3-ylpentanediamide;hydrochloride
CID 119428545
2,2-dimethyl-N-[4-oxo-4-(piperidin-3-ylamino)butyl]propanamide
CID 119426962
2-cyclohexyl-N-[(3S)-piperidin-3-yl]acetamide
CID 92664479
4-cyclobutyl-N-[4-(hydroxymethyl)cyclohexyl]butanamide
CID 115277387
cis-(1R,3S)-3-(4-cyclohexylbutanoylamino)cyclopentane-1-carboxylic acid
CID 106320958
4-cyclopentyl-N-(1,1-dioxothian-3-yl)butanamide
CID 71994756
N-piperidin-3-yl-N'-propan-2-ylpentanediamide
CID 119425960
4-(cyclohexylcarbamoylamino)-N-piperidin-3-ylbutanamide
CID 119425673

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride?
The IUPAC name of 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride (CID 119454408) is 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride.
What is the SMILES notation for 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride?
The canonical SMILES for 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride is Cl.O=C(CCCC1CCCC1)NC1CCNC1.
What is the InChIKey of 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride?
The InChIKey is PZWOBDKYCUTSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c16-13(15-12-8-9-14-10-12)7-3-6-11-4-1-2-5-11;/h11-12,14H,1-10H2,(H,15,16);1H.
What are the key properties of 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride?
4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-pyrrolidin-3-ylbutanamide;hydrochloride is sourced from PubChem (CID 119454408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).