N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide

C20H31N3O — CID 122556162

IUPACN-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
SMILESCCCCC(NC(=O)C1(N2CCCC2)CCCC1)c1cccnc1
InChIInChI=1S/C20H31N3O/c1-2-3-10-18(17-9-8-13-21-16-17)22-19(24)20(11-4-5-12-20)23-14-6-7-15-23/h8-9,13,16,18H,2-7,10-12,14-15H2,1H3,(H,22,24)
InChIKeyKMRZCQCLTXBZHY-UHFFFAOYSA-N
MW329.49 g/mol
LogP3.84
Rot. Bonds7

About N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide

N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide (PubChem CID 122556162) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
PubChem CID122556162
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC NameN-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
SMILESCCCCC(NC(=O)C1(N2CCCC2)CCCC1)c1cccnc1
InChIInChI=1S/C20H31N3O/c1-2-3-10-18(17-9-8-13-21-16-17)22-19(24)20(11-4-5-12-20)23-14-6-7-15-23/h8-9,13,16,18H,2-7,10-12,14-15H2,1H3,(H,22,24)
InChIKeyKMRZCQCLTXBZHY-UHFFFAOYSA-N
XLogP3.84
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-piperidin-1-yl-N-(1-pyridin-3-ylpropyl)cyclohexane-1-carboxamide
CID 91787819
3-oxo-N-[(1S)-1-pyridin-3-ylpentyl]-1,4-diazepane-1-carboxamide
CID 125448228
3-fluoro-N-[(1S)-1-pyridin-3-ylpentyl]pyridine-4-carboxamide
CID 125447618
2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-N-(1-pyridin-3-ylpentyl)acetamide
CID 122570848
2-(3-chloro-4-hydroxyphenyl)-N-(1-pyridin-3-ylpentyl)acetamide
CID 91783750
4-oxo-N-(1-pyridin-3-ylpentyl)-3H-phthalazine-1-carboxamide
CID 91774680
3-(4-methyl-1,2,4-triazol-3-yl)-N-[(1R)-1-pyridin-3-ylpentyl]propanamide
CID 126431719
N-[(2S)-1-(3-methyl-2-pyridinyl)propan-2-yl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 124852129
N-(cyclohexylmethyl)-1-pyridin-3-ylpentan-1-amine
CID 56676007
N-[(S)-(1-methylimidazol-2-yl)-phenylmethyl]-1-pyrrolidin-1-ylcyclopentane-1-carboxamide
CID 99940755
2-(4-oxothieno[3,2-d]pyrimidin-3-yl)-N-(1-pyridin-3-ylpentyl)acetamide
CID 118782889
N-(1-phenylheptyl)pyridine-3-carboxamide
CID 54544628

Frequently Asked Questions

What is the IUPAC name of N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The IUPAC name of N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide (CID 122556162) is N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The canonical SMILES for N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide is CCCCC(NC(=O)C1(N2CCCC2)CCCC1)c1cccnc1.
What is the InChIKey of N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
The InChIKey is KMRZCQCLTXBZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-2-3-10-18(17-9-8-13-21-16-17)22-19(24)20(11-4-5-12-20)23-14-6-7-15-23/h8-9,13,16,18H,2-7,10-12,14-15H2,1H3,(H,22,24).
What are the key properties of N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide?
N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide has a molecular weight of 329.49 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyridin-3-ylpentyl)-1-pyrrolidin-1-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 122556162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).