N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline

C15H19N3 — CID 113489788

IUPACN-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline
SMILESCC(CC1CC1)Nc1ccc(-c2cnc[nH]2)cc1
InChIInChI=1S/C15H19N3/c1-11(8-12-2-3-12)18-14-6-4-13(5-7-14)15-9-16-10-17-15/h4-7,9-12,18H,2-3,8H2,1H3,(H,16,17)
InChIKeyUCUVYPKNXQRMPK-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.68
Rot. Bonds5

About N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline

N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline (PubChem CID 113489788) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline
PubChem CID113489788
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline
SMILESCC(CC1CC1)Nc1ccc(-c2cnc[nH]2)cc1
InChIInChI=1S/C15H19N3/c1-11(8-12-2-3-12)18-14-6-4-13(5-7-14)15-9-16-10-17-15/h4-7,9-12,18H,2-3,8H2,1H3,(H,16,17)
InChIKeyUCUVYPKNXQRMPK-UHFFFAOYSA-N
XLogP3.68
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-cyclohexylethyl)-4-(1H-imidazol-5-yl)aniline
CID 43786474
N-hex-5-en-2-yl-4-(1H-imidazol-5-yl)aniline
CID 113437865
4-(1H-imidazol-5-yl)-N-(3-methylpentan-2-yl)aniline
CID 43722361
N-cyclopropyl-4-(1H-imidazol-5-yl)aniline
CID 103439039
N-(3-ethylcyclopentyl)-4-(1H-imidazol-5-yl)aniline
CID 64501713
tert-butyl N-[2-[4-(1H-imidazol-5-yl)anilino]propyl]carbamate
CID 103388551
N-cyclopentyl-4-(1H-imidazol-5-yl)aniline
CID 43722405
N-[4-(1H-imidazol-5-yl)phenyl]-N'-(2-methylpropyl)methanimidamide;hydrochloride
CID 45261847
4-(1H-imidazol-5-yl)-N-[1-(2-methylphenyl)ethyl]aniline
CID 43722465
N-(1-cyclopropylpropan-2-yl)-4-propan-2-yloxyaniline
CID 115917457
N-[4-(1H-imidazol-5-yl)phenyl]cyclooctanamine
CID 43722407
N-[4-(1H-imidazol-5-yl)phenyl]-4,4-dimethylcycloheptan-1-amine
CID 65084298

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline (CID 113489788) is N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline is CC(CC1CC1)Nc1ccc(-c2cnc[nH]2)cc1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline?
The InChIKey is UCUVYPKNXQRMPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11(8-12-2-3-12)18-14-6-4-13(5-7-14)15-9-16-10-17-15/h4-7,9-12,18H,2-3,8H2,1H3,(H,16,17).
What are the key properties of N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline?
N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline has a molecular weight of 241.34 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-4-(1H-imidazol-5-yl)aniline is sourced from PubChem (CID 113489788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).