N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine

C16H29N3 — CID 104747735

IUPACN-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
SMILESCCCNC(Cn1ccnc1CCC)C1CCCC1
InChIInChI=1S/C16H29N3/c1-3-7-16-18-11-12-19(16)13-15(17-10-4-2)14-8-5-6-9-14/h11-12,14-15,17H,3-10,13H2,1-2H3
InChIKeyZKWRDUKHGLJCEN-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.39
Rot. Bonds8

About N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine

N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine (PubChem CID 104747735) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
PubChem CID104747735
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC NameN-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
SMILESCCCNC(Cn1ccnc1CCC)C1CCCC1
InChIInChI=1S/C16H29N3/c1-3-7-16-18-11-12-19(16)13-15(17-10-4-2)14-8-5-6-9-14/h11-12,14-15,17H,3-10,13H2,1-2H3
InChIKeyZKWRDUKHGLJCEN-UHFFFAOYSA-N
XLogP3.39
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(oxolan-3-yl)-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
CID 104747739
N-[1-cyclohexyl-2-(2-propan-2-ylimidazol-1-yl)ethyl]propan-1-amine
CID 104747255
N-[1-cyclopropyl-2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
CID 63912853
1-cyclopropyl-N-propyl-4-(1-propylimidazol-2-yl)butan-1-amine
CID 79762298
1-cyclohexyl-N-ethyl-2-(1-propylimidazol-2-yl)ethanamine
CID 79751471
1-[2-cyclohexyl-2-(propylamino)ethyl]-3-ethylimidazol-2-one
CID 104748010
N-[1-cyclohexyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)ethyl]propan-1-amine
CID 104748080
N-[1-cyclopentyl-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]propan-1-amine
CID 104746081
1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine
CID 63912643
1-cyclopropyl-N-ethyl-4-(1-ethylimidazol-2-yl)butan-1-amine
CID 79762173
1-cyclobutyl-N-methyl-2-(1-propylimidazol-2-yl)ethanamine
CID 79760970
2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
CID 64810250

Frequently Asked Questions

What is the IUPAC name of N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine?
The IUPAC name of N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine (CID 104747735) is N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine is CCCNC(Cn1ccnc1CCC)C1CCCC1.
What is the InChIKey of N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine?
The InChIKey is ZKWRDUKHGLJCEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-3-7-16-18-11-12-19(16)13-15(17-10-4-2)14-8-5-6-9-14/h11-12,14-15,17H,3-10,13H2,1-2H3.
What are the key properties of N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine?
N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine has a molecular weight of 263.43 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine is sourced from PubChem (CID 104747735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).