1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine

C21H30N4 — CID 154750461

IUPAC1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine
SMILESCC(NC1CCN(C2CCCC2)CC1)c1cccc(-n2ccnc2)c1
InChIInChI=1S/C21H30N4/c1-17(18-5-4-8-21(15-18)25-14-11-22-16-25)23-19-9-12-24(13-10-19)20-6-2-3-7-20/h4-5,8,11,14-17,19-20,23H,2-3,6-7,9-10,12-13H2,1H3
InChIKeyZLCSWUKWEUJSHC-UHFFFAOYSA-N
MW338.50 g/mol
LogP3.93
Rot. Bonds5

About 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine

1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine (PubChem CID 154750461) has the molecular formula C21H30N4 and a molecular weight of 338.50 g/mol. Its IUPAC name is 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine
PubChem CID154750461
Molecular FormulaC21H30N4
Molecular Weight338.50 g/mol
Exact Mass338.25
IUPAC Name1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine
SMILESCC(NC1CCN(C2CCCC2)CC1)c1cccc(-n2ccnc2)c1
InChIInChI=1S/C21H30N4/c1-17(18-5-4-8-21(15-18)25-14-11-22-16-25)23-19-9-12-24(13-10-19)20-6-2-3-7-20/h4-5,8,11,14-17,19-20,23H,2-3,6-7,9-10,12-13H2,1H3
InChIKeyZLCSWUKWEUJSHC-UHFFFAOYSA-N
XLogP3.93
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-3-(hydroxymethyl)-N-[(1S)-1-(3-imidazol-1-ylphenyl)ethyl]piperidine-1-carboxamide
CID 95969134
N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-methylpiperidin-4-amine
CID 43215873
(3R)-3-(dimethylamino)-N-[(1S)-1-(3-imidazol-1-ylphenyl)ethyl]piperidine-1-carboxamide
CID 95969150
1-(3-imidazol-1-ylphenyl)ethanol
CID 50973411
N-(1,3-dioxolan-2-ylmethyl)-1-(3-imidazol-1-ylphenyl)ethanamine
CID 86818574
N-[1-(4-imidazol-1-ylphenyl)ethyl]-1-methylpiperidin-3-amine
CID 61210084
2-[1-(3-imidazol-1-ylphenyl)ethylamino]-N-(oxan-4-yl)acetamide
CID 86806189
1-cyclopropyl-N-[(1S)-1-(3-methylphenyl)ethyl]pyrrolidin-3-amine
CID 81364151
3-imidazol-1-yl-N-(4-propan-2-ylcyclohexyl)aniline
CID 63428404
[4-[[[(1S)-1-(3-imidazol-1-ylphenyl)ethyl]amino]methyl]phenyl]methanol
CID 99858451
N-[1-(3-methoxyphenyl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 79690670
N-[(1R)-1-(3-pyrazol-1-ylphenyl)ethyl]-1-pyridin-2-ylpiperidin-4-amine
CID 97323181

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine?
The IUPAC name of 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine (CID 154750461) is 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine is CC(NC1CCN(C2CCCC2)CC1)c1cccc(-n2ccnc2)c1.
What is the InChIKey of 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine?
The InChIKey is ZLCSWUKWEUJSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4/c1-17(18-5-4-8-21(15-18)25-14-11-22-16-25)23-19-9-12-24(13-10-19)20-6-2-3-7-20/h4-5,8,11,14-17,19-20,23H,2-3,6-7,9-10,12-13H2,1H3.
What are the key properties of 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine?
1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine has a molecular weight of 338.50 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[1-(3-imidazol-1-ylphenyl)ethyl]piperidin-4-amine is sourced from PubChem (CID 154750461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).