N-cycloheptyl-1-phenylimidazol-2-amine

C16H21N3 — CID 106561276

IUPACN-cycloheptyl-1-phenylimidazol-2-amine
SMILESc1ccc(-n2ccnc2NC2CCCCCC2)cc1
InChIInChI=1S/C16H21N3/c1-2-5-9-14(8-4-1)18-16-17-12-13-19(16)15-10-6-3-7-11-15/h3,6-7,10-14H,1-2,4-5,8-9H2,(H,17,18)
InChIKeyWKIIANLSQDVQIP-UHFFFAOYSA-N
MW255.37 g/mol
LogP4.01
Rot. Bonds3

About N-cycloheptyl-1-phenylimidazol-2-amine

N-cycloheptyl-1-phenylimidazol-2-amine (PubChem CID 106561276) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is N-cycloheptyl-1-phenylimidazol-2-amine.

Molecular Properties

Compound NameN-cycloheptyl-1-phenylimidazol-2-amine
PubChem CID106561276
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC NameN-cycloheptyl-1-phenylimidazol-2-amine
SMILESc1ccc(-n2ccnc2NC2CCCCCC2)cc1
InChIInChI=1S/C16H21N3/c1-2-5-9-14(8-4-1)18-16-17-12-13-19(16)15-10-6-3-7-11-15/h3,6-7,10-14H,1-2,4-5,8-9H2,(H,17,18)
InChIKeyWKIIANLSQDVQIP-UHFFFAOYSA-N
XLogP4.01
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-phenylimidazol-2-yl)piperidin-4-amine
CID 115044800
N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
CID 106554214
1-(2-chlorophenyl)-N-cyclohexylimidazol-2-amine
CID 106558771
N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine
CID 106575351
N-(cyclohexylmethyl)-1-phenylimidazol-2-amine
CID 106561651
1-ethyl-N-(1-phenylimidazol-2-yl)piperidin-3-amine
CID 106565174
N-cyclopentyl-1-(3-ethylphenyl)imidazol-2-amine
CID 106559803
N-(2,2-dimethylcyclohexyl)-1-phenylimidazol-2-amine
CID 106576686
N-cyclohexyl-1-(3,4,5-trifluorophenyl)imidazol-2-amine
CID 106570813
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
CID 106566737
N-cyclopentyl-1-(3,5-dichlorophenyl)imidazol-2-amine
CID 106557230

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-1-phenylimidazol-2-amine?
The IUPAC name of N-cycloheptyl-1-phenylimidazol-2-amine (CID 106561276) is N-cycloheptyl-1-phenylimidazol-2-amine.
What is the SMILES notation for N-cycloheptyl-1-phenylimidazol-2-amine?
The canonical SMILES for N-cycloheptyl-1-phenylimidazol-2-amine is c1ccc(-n2ccnc2NC2CCCCCC2)cc1.
What is the InChIKey of N-cycloheptyl-1-phenylimidazol-2-amine?
The InChIKey is WKIIANLSQDVQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-2-5-9-14(8-4-1)18-16-17-12-13-19(16)15-10-6-3-7-11-15/h3,6-7,10-14H,1-2,4-5,8-9H2,(H,17,18).
What are the key properties of N-cycloheptyl-1-phenylimidazol-2-amine?
N-cycloheptyl-1-phenylimidazol-2-amine has a molecular weight of 255.37 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-1-phenylimidazol-2-amine is sourced from PubChem (CID 106561276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).