1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine

C13H21N3O — CID 106573279

IUPAC1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine
SMILESc1cn(C2CCCC2)c(NC2CCCOC2)n1
InChIInChI=1S/C13H21N3O/c1-2-6-12(5-1)16-8-7-14-13(16)15-11-4-3-9-17-10-11/h7-8,11-12H,1-6,9-10H2,(H,14,15)
InChIKeyYJKXRDUNUJPHAR-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.59
Rot. Bonds3

About 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine

1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine (PubChem CID 106573279) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine
PubChem CID106573279
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine
SMILESc1cn(C2CCCC2)c(NC2CCCOC2)n1
InChIInChI=1S/C13H21N3O/c1-2-6-12(5-1)16-8-7-14-13(16)15-11-4-3-9-17-10-11/h7-8,11-12H,1-6,9-10H2,(H,14,15)
InChIKeyYJKXRDUNUJPHAR-UHFFFAOYSA-N
XLogP2.59
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-1-cyclopropylimidazol-2-amine
CID 106554935
N,1-dicyclopropylimidazol-2-amine
CID 106554949
N-ethyl-1-(oxan-3-yl)imidazol-2-amine
CID 106573282
N-cyclohexyl-1-(4,4-dimethylcyclohexyl)imidazol-2-amine
CID 106574656
1-cyclohexyl-N-(3,3-dimethylcyclohexyl)imidazol-2-amine
CID 106577714
N-(1-cyclopropylimidazol-2-yl)piperidin-4-amine
CID 115024886
[1-(oxan-3-yl)imidazol-2-yl]methanamine
CID 84732373
1-methyl-3-(oxan-3-ylamino)pyrazin-2-one
CID 63363573
N-cyclopentyl-1-(3,4-dimethylcyclohexyl)imidazol-2-amine
CID 106574575
1-cyclohexyl-N-(2-propan-2-ylcyclohexyl)imidazol-2-amine
CID 106579254
3-N-[(3S)-oxan-3-yl]pyrazine-2,3-diamine
CID 130627526
N-ethyl-1-(oxolan-3-yl)imidazol-2-amine
CID 106577306

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine (CID 106573279) is 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine is c1cn(C2CCCC2)c(NC2CCCOC2)n1.
What is the InChIKey of 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine?
The InChIKey is YJKXRDUNUJPHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-6-12(5-1)16-8-7-14-13(16)15-11-4-3-9-17-10-11/h7-8,11-12H,1-6,9-10H2,(H,14,15).
What are the key properties of 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine?
1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine has a molecular weight of 235.33 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine is sourced from PubChem (CID 106573279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).