N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine

C16H21N3O — CID 106566737

IUPACN-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
SMILESCCOc1cccc(-n2ccnc2NC2CCCC2)c1
InChIInChI=1S/C16H21N3O/c1-2-20-15-9-5-8-14(12-15)19-11-10-17-16(19)18-13-6-3-4-7-13/h5,8-13H,2-4,6-7H2,1H3,(H,17,18)
InChIKeyXFERIIMHSFXEOF-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.63
Rot. Bonds5

About N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine

N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine (PubChem CID 106566737) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
PubChem CID106566737
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
SMILESCCOc1cccc(-n2ccnc2NC2CCCC2)c1
InChIInChI=1S/C16H21N3O/c1-2-20-15-9-5-8-14(12-15)19-11-10-17-16(19)18-13-6-3-4-7-13/h5,8-13H,2-4,6-7H2,1H3,(H,17,18)
InChIKeyXFERIIMHSFXEOF-UHFFFAOYSA-N
XLogP3.63
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-1-(3-ethylphenyl)imidazol-2-amine
CID 106559803
N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
N-cyclopropyl-1-(4-ethoxyphenyl)imidazol-2-amine
CID 106555769
N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine
CID 106566756
N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
CID 106554214
N-cycloheptyl-1-phenylimidazol-2-amine
CID 106561276
N-cyclopentyl-1-(3,4-dimethylphenyl)imidazol-2-amine
CID 106560237
N-(3-ethoxyphenyl)-1-phenylimidazol-2-amine
CID 106566765
N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
CID 106564117
1-(4-chloro-3-methoxyphenyl)-N-cyclohexylimidazol-2-amine
CID 107623823
1-(3-bromo-4-fluorophenyl)-N-cyclopentylimidazol-2-amine
CID 106581538
1-ethyl-N-(1-phenylimidazol-2-yl)piperidin-3-amine
CID 106565174

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine (CID 106566737) is N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine is CCOc1cccc(-n2ccnc2NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine?
The InChIKey is XFERIIMHSFXEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-20-15-9-5-8-14(12-15)19-11-10-17-16(19)18-13-6-3-4-7-13/h5,8-13H,2-4,6-7H2,1H3,(H,17,18).
What are the key properties of N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine?
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine has a molecular weight of 271.36 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine is sourced from PubChem (CID 106566737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).