2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine

C12H22N4O — CID 116502917

IUPAC2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine
SMILESCOCC(C)c1nc(C2CCCC2)n(N)c1N
InChIInChI=1S/C12H22N4O/c1-8(7-17-2)10-11(13)16(14)12(15-10)9-5-3-4-6-9/h8-9H,3-7,13-14H2,1-2H3
InChIKeyCQCCKXICXJFVNR-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.59
Rot. Bonds4

About 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine

2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine (PubChem CID 116502917) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine
PubChem CID116502917
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine
SMILESCOCC(C)c1nc(C2CCCC2)n(N)c1N
InChIInChI=1S/C12H22N4O/c1-8(7-17-2)10-11(13)16(14)12(15-10)9-5-3-4-6-9/h8-9H,3-7,13-14H2,1-2H3
InChIKeyCQCCKXICXJFVNR-UHFFFAOYSA-N
XLogP1.59
TPSA79.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine
CID 114201131
2,3-dicyclopropyl-5-(1-methoxypropan-2-yl)imidazol-4-amine
CID 116502871
2-(1-methoxypropan-2-yl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-amine
CID 116503607
2-cyclohexyl-3-cyclopropyl-5-pentan-2-ylimidazol-4-amine
CID 62222251
2-tert-butyl-5-(1-methoxypropan-2-yl)-3-propylimidazol-4-amine
CID 116502877
2-cyclopentyl-5-pentan-2-yl-3-prop-2-ynylimidazol-4-amine
CID 55048559
2-cyclohexyl-5-propan-2-yl-3-propylimidazol-4-amine
CID 55048700
3-cyclopropyl-5-(1-methoxypropan-2-yl)-2-phenylimidazol-4-amine
CID 116502906
2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine
CID 55080057
2-(1-methoxypropan-2-yl)-5,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-amine
CID 114933623
2-cyclohexyl-4-pentylimidazole-1,5-diamine
CID 62507105
2-cyclopentyl-5-ethyl-3-propan-2-ylimidazol-4-amine
CID 62219181

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine (CID 116502917) is 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine is COCC(C)c1nc(C2CCCC2)n(N)c1N.
What is the InChIKey of 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine?
The InChIKey is CQCCKXICXJFVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-8(7-17-2)10-11(13)16(14)12(15-10)9-5-3-4-6-9/h8-9H,3-7,13-14H2,1-2H3.
What are the key properties of 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine?
2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine has a molecular weight of 238.33 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-4-(1-methoxypropan-2-yl)imidazole-1,5-diamine is sourced from PubChem (CID 116502917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).