1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine

C12H21N3 — CID 114530015

IUPAC1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine
SMILESCn1ccnc1CCC(N)C1CCCC1
InChIInChI=1S/C12H21N3/c1-15-9-8-14-12(15)7-6-11(13)10-4-2-3-5-10/h8-11H,2-7,13H2,1H3
InChIKeyIKXHURJUEDZHRJ-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.87
Rot. Bonds4

About 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine

1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine (PubChem CID 114530015) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine
PubChem CID114530015
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine
SMILESCn1ccnc1CCC(N)C1CCCC1
InChIInChI=1S/C12H21N3/c1-15-9-8-14-12(15)7-6-11(13)10-4-2-3-5-10/h8-11H,2-7,13H2,1H3
InChIKeyIKXHURJUEDZHRJ-UHFFFAOYSA-N
XLogP1.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-bicyclo[4.1.0]heptanyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105050153
1-(4-ethylcyclohexyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530310
1-cyclobutyl-N-methyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530243
1-(2,3-dihydro-1H-inden-2-yl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530343
[1-cycloheptyl-4-(1-methylimidazol-2-yl)butan-2-yl]hydrazine
CID 105340281
[1-cyclohexyl-1-ethoxy-4-(1-methylimidazol-2-yl)butan-2-yl]hydrazine
CID 105278913
N-tert-butyl-2-cyclopentyl-4-(1-methylimidazol-2-yl)butan-1-amine
CID 114531599
1-cyclopentyl-5-(1-methylimidazol-2-yl)pentan-3-ol
CID 115838050
N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
CID 61214993
2-(1-methylimidazol-2-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 105167192
1-methyl-2-(3-methylbutyl)imidazole
CID 68983412
1,1-difluoro-4-(1-methylimidazol-2-yl)butan-2-amine
CID 103517203

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine?
The IUPAC name of 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine (CID 114530015) is 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine.
What is the SMILES notation for 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine?
The canonical SMILES for 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine is Cn1ccnc1CCC(N)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine?
The InChIKey is IKXHURJUEDZHRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-15-9-8-14-12(15)7-6-11(13)10-4-2-3-5-10/h8-11H,2-7,13H2,1H3.
What are the key properties of 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine?
1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine is sourced from PubChem (CID 114530015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).