4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine

C18H33N3 — CID 105012343

IUPAC4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
SMILESCCCNC(CCC1CCCC1)Cc1nccn1CCC
InChIInChI=1S/C18H33N3/c1-3-11-19-17(10-9-16-7-5-6-8-16)15-18-20-12-14-21(18)13-4-2/h12,14,16-17,19H,3-11,13,15H2,1-2H3
InChIKeyFGQYUURRBGOVQK-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.17
Rot. Bonds10

About 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine

4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine (PubChem CID 105012343) has the molecular formula C18H33N3 and a molecular weight of 291.48 g/mol. Its IUPAC name is 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
PubChem CID105012343
Molecular FormulaC18H33N3
Molecular Weight291.48 g/mol
Exact Mass291.27
IUPAC Name4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
SMILESCCCNC(CCC1CCCC1)Cc1nccn1CCC
InChIInChI=1S/C18H33N3/c1-3-11-19-17(10-9-16-7-5-6-8-16)15-18-20-12-14-21(18)13-4-2/h12,14,16-17,19H,3-11,13,15H2,1-2H3
InChIKeyFGQYUURRBGOVQK-UHFFFAOYSA-N
XLogP4.17
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-N-ethyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 105012509
N-propyl-1-(1-propylimidazol-2-yl)heptan-2-amine
CID 105012472
4-cyclohexyl-1-(2-methyl-1,2,4-triazol-3-yl)-N-propylbutan-2-amine
CID 104997751
1-cyclohexyl-N-ethyl-3-(1-propylimidazol-2-yl)propan-2-amine
CID 105012316
5-methoxy-N-propyl-1-(1-propylimidazol-2-yl)pentan-2-amine
CID 79761113
4,5,5-trimethyl-N-propyl-1-(1-propylimidazol-2-yl)hexan-2-amine
CID 105012491
1-methylsulfonyl-N-propyl-3-(1-propylimidazol-2-yl)propan-2-amine
CID 105012195
3,3-dimethyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine
CID 79753036
N-propyl-1-(1-propylimidazol-2-yl)-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103215840
1-cyclohexyl-N-ethyl-2-(1-propylimidazol-2-yl)ethanamine
CID 79751471
1-cyclopropyl-N-propyl-4-(1-propylimidazol-2-yl)butan-1-amine
CID 79762298
N-propyl-1-(1-propylimidazol-2-yl)-3-pyridin-2-ylpropan-2-amine
CID 79752625

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine?
The IUPAC name of 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine (CID 105012343) is 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine.
What is the SMILES notation for 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine?
The canonical SMILES for 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine is CCCNC(CCC1CCCC1)Cc1nccn1CCC.
What is the InChIKey of 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine?
The InChIKey is FGQYUURRBGOVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3/c1-3-11-19-17(10-9-16-7-5-6-8-16)15-18-20-12-14-21(18)13-4-2/h12,14,16-17,19H,3-11,13,15H2,1-2H3.
What are the key properties of 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine?
4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine has a molecular weight of 291.48 g/mol, XLogP of 4.17, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-propyl-1-(1-propylimidazol-2-yl)butan-2-amine is sourced from PubChem (CID 105012343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).