1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine

C13H21N3 — CID 106555211

IUPAC1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine
SMILESCc1cn(C2CCCC2)c(NCC2CC2)n1
InChIInChI=1S/C13H21N3/c1-10-9-16(12-4-2-3-5-12)13(15-10)14-8-11-6-7-11/h9,11-12H,2-8H2,1H3,(H,14,15)
InChIKeyUAXPXMFGNDWZME-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.13
Rot. Bonds4

About 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine

1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine (PubChem CID 106555211) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine
PubChem CID106555211
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine
SMILESCc1cn(C2CCCC2)c(NCC2CC2)n1
InChIInChI=1S/C13H21N3/c1-10-9-16(12-4-2-3-5-12)13(15-10)14-8-11-6-7-11/h9,11-12H,2-8H2,1H3,(H,14,15)
InChIKeyUAXPXMFGNDWZME-UHFFFAOYSA-N
XLogP3.13
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-N-ethyl-4-methylimidazol-2-amine
CID 106554643
N-(2-cyclohexylethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106563352
1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157
1-cyclohexyl-4-methyl-N-[(1-methylpiperidin-2-yl)methyl]imidazol-2-amine
CID 106565250
1-cyclooctyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106557175
1-cyclopentyl-4-methyl-N-[(4-methylmorpholin-2-yl)methyl]imidazol-2-amine
CID 106576055
1-cyclohexyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557289
1-cyclopentyl-N-(3-ethoxypropyl)-4-methylimidazol-2-amine
CID 106554998
N-(2-butoxyethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106568338
1-cyclopentyl-4-methyl-N-[(4-methylphenyl)methyl]imidazol-2-amine
CID 106559875
1-cyclohexyl-N-hexyl-4-methylimidazol-2-amine
CID 106573799
1-cyclopentyl-N-(1-cyclopropylbutan-2-yl)-4-methylimidazol-2-amine
CID 106573524

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine (CID 106555211) is 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine is Cc1cn(C2CCCC2)c(NCC2CC2)n1.
What is the InChIKey of 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine?
The InChIKey is UAXPXMFGNDWZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-9-16(12-4-2-3-5-12)13(15-10)14-8-11-6-7-11/h9,11-12H,2-8H2,1H3,(H,14,15).
What are the key properties of 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine?
1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine has a molecular weight of 219.33 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(cyclopropylmethyl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106555211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).