N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine

C17H23N3O — CID 106566756

IUPACN-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine
SMILESCCOc1cccc(-n2cc(C)nc2NC2CCCC2)c1
InChIInChI=1S/C17H23N3O/c1-3-21-16-10-6-9-15(11-16)20-12-13(2)18-17(20)19-14-7-4-5-8-14/h6,9-12,14H,3-5,7-8H2,1-2H3,(H,18,19)
InChIKeyQOCXCMQRXSYOJZ-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.93
Rot. Bonds5

About N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine

N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine (PubChem CID 106566756) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine
PubChem CID106566756
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine
SMILESCCOc1cccc(-n2cc(C)nc2NC2CCCC2)c1
InChIInChI=1S/C17H23N3O/c1-3-21-16-10-6-9-15(11-16)20-12-13(2)18-17(20)19-14-7-4-5-8-14/h6,9-12,14H,3-5,7-8H2,1-2H3,(H,18,19)
InChIKeyQOCXCMQRXSYOJZ-UHFFFAOYSA-N
XLogP3.93
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-(4-ethoxyphenyl)-4-methylimidazol-2-amine
CID 106555778
1-(3-bromophenyl)-N-cyclohexyl-4-methylimidazol-2-amine
CID 106558666
N-cyclohexyl-1-(3-iodophenyl)-4-methylimidazol-2-amine
CID 106554243
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
CID 106566737
1-(3-chlorophenyl)-N-cyclohexyl-4-methylimidazol-2-amine
CID 106558404
1-(3-ethoxyphenyl)-N-ethyl-4-methylimidazol-2-amine
CID 106566744
1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine
CID 106558608
N-cyclohexyl-4-methyl-1-(1-methylpyrazol-4-yl)imidazol-2-amine
CID 106562135
N-cyclopentyl-1-(2-iodophenyl)-4-methylimidazol-2-amine
CID 106554290
N-cyclopropyl-4-methyl-1-(4-propylphenyl)imidazol-2-amine
CID 106561564
1-(3-methoxyphenyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106559929
1-(2-chloro-4-methylphenyl)-N-cyclopentyl-4-methylimidazol-2-amine
CID 106560891

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine (CID 106566756) is N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine is CCOc1cccc(-n2cc(C)nc2NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine?
The InChIKey is QOCXCMQRXSYOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-21-16-10-6-9-15(11-16)20-12-13(2)18-17(20)19-14-7-4-5-8-14/h6,9-12,14H,3-5,7-8H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine?
N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine has a molecular weight of 285.39 g/mol, XLogP of 3.93, 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)-4-methylimidazol-2-amine is sourced from PubChem (CID 106566756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).