N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine

C15H24N6 — CID 56713810

IUPACN-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine
SMILESCC(Cn1ccnc1)NCc1nncn1C1CCCCC1
InChIInChI=1S/C15H24N6/c1-13(10-20-8-7-16-11-20)17-9-15-19-18-12-21(15)14-5-3-2-4-6-14/h7-8,11-14,17H,2-6,9-10H2,1H3
InChIKeySIRWTOZVTIXURD-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.16
Rot. Bonds6

About N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine

N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine (PubChem CID 56713810) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine
PubChem CID56713810
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC NameN-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine
SMILESCC(Cn1ccnc1)NCc1nncn1C1CCCCC1
InChIInChI=1S/C15H24N6/c1-13(10-20-8-7-16-11-20)17-9-15-19-18-12-21(15)14-5-3-2-4-6-14/h7-8,11-14,17H,2-6,9-10H2,1H3
InChIKeySIRWTOZVTIXURD-UHFFFAOYSA-N
XLogP2.16
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine 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

2-[4-[4-Cyclopropyl-5-(imidazol-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]ethanamine
CID 72918546
2-methyl-1-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 61686283
1-(2-Imidazol-1-ylethyl)-3-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]urea
CID 53521957
1-(3-Imidazol-1-ylpropyl)-3-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]urea
CID 71894160
N-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-N-methyl-1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-amine
CID 71928265
1-cyclohexyl-3-[5-(1H-imidazol-1-ylmethyl)-4-methyl-4H-1,2,4-triazol-3-yl]piperidine
CID 72866892
2-ethyl-1-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 61685971
N-methyl-1-(1-methylimidazol-2-yl)-N-[(1-propyltetrazol-5-yl)methyl]methanamine
CID 71943990
2-[(1-cyclohexyl-3-methyl-1H-1,2,4-triazol-5-yl)methyl]-2H-1,2,3-triazole
CID 72892589
1-butyl-5-[(1S)-1-(2-methylimidazol-1-yl)ethyl]-3-(2-methylpropyl)-1,2,4-triazole
CID 97452482
1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]-4-imidazol-1-ylpiperidine
CID 124623739
4-imidazol-1-yl-1-[(3-propan-2-yl-1H-1,2,4-triazol-5-yl)methyl]piperidine
CID 132383679

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine?
The IUPAC name of N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine (CID 56713810) is N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine.
What is the SMILES notation for N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine?
The canonical SMILES for N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine is CC(Cn1ccnc1)NCc1nncn1C1CCCCC1.
What is the InChIKey of N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine?
The InChIKey is SIRWTOZVTIXURD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-13(10-20-8-7-16-11-20)17-9-15-19-18-12-21(15)14-5-3-2-4-6-14/h7-8,11-14,17H,2-6,9-10H2,1H3.
What are the key properties of N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine?
N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine has a molecular weight of 288.40 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-1-imidazol-1-ylpropan-2-amine is sourced from PubChem (CID 56713810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).