5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine

C15H19N5 — CID 56747840

IUPAC5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine
SMILESNc1ncc(-c2nccn2CCC2=CCCCC2)cn1
InChIInChI=1S/C15H19N5/c16-15-18-10-13(11-19-15)14-17-7-9-20(14)8-6-12-4-2-1-3-5-12/h4,7,9-11H,1-3,5-6,8H2,(H2,16,18,19)
InChIKeyFYJWJRMZACIFSG-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.81
Rot. Bonds4

About 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine

5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine (PubChem CID 56747840) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine
PubChem CID56747840
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine
SMILESNc1ncc(-c2nccn2CCC2=CCCCC2)cn1
InChIInChI=1S/C15H19N5/c16-15-18-10-13(11-19-15)14-17-7-9-20(14)8-6-12-4-2-1-3-5-12/h4,7,9-11H,1-3,5-6,8H2,(H2,16,18,19)
InChIKeyFYJWJRMZACIFSG-UHFFFAOYSA-N
XLogP2.81
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-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-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]sulfanylethanol
CID 94690828
3-[2-(cyclohexen-1-yl)ethylamino]-1-ethylpyrazin-2-one
CID 62939867
1-[2-(cyclohexen-1-yl)ethyl]-2-methyl-3-[4-(2-methylimidazol-1-yl)butyl]guanidine
CID 111773412
2-(cyclohexen-1-yl)-1-(1-ethylimidazol-2-yl)ethanamine
CID 116661175
1-(cyclohexen-1-yl)-3-(1-propylimidazol-2-yl)propan-2-one
CID 116659612
4-[4-[2-(cyclohexen-1-yl)ethyl]-5-methyl-1,2,4-triazol-3-yl]-1-methylpyrazol-5-amine
CID 3337328
1-[2-(cyclohexen-1-yl)ethyl]-4-methyl-2-oxopyridine-3-carboxylic acid
CID 82121678
1-(cyclohexen-1-yl)-3-(1-methylimidazol-2-yl)propan-2-amine
CID 116661214
4-[1-[2-(2-methylpyrazol-3-yl)ethyl]imidazol-2-yl]aniline
CID 103002374
N-[2-(cyclohexen-1-yl)ethyl]-4-[(1-methylimidazol-2-yl)sulfanylmethyl]benzamide
CID 39082781
3-[2-(4-aminophenyl)imidazol-1-yl]propanamide
CID 60998965
cyclododecen-1-ylmethanamine
CID 70571219

Frequently Asked Questions

What is the IUPAC name of 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine?
The IUPAC name of 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine (CID 56747840) is 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine.
What is the SMILES notation for 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine?
The canonical SMILES for 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine is Nc1ncc(-c2nccn2CCC2=CCCCC2)cn1.
What is the InChIKey of 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine?
The InChIKey is FYJWJRMZACIFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c16-15-18-10-13(11-19-15)14-17-7-9-20(14)8-6-12-4-2-1-3-5-12/h4,7,9-11H,1-3,5-6,8H2,(H2,16,18,19).
What are the key properties of 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine?
5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine has a molecular weight of 269.35 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[2-(cyclohexen-1-yl)ethyl]imidazol-2-yl]pyrimidin-2-amine is sourced from PubChem (CID 56747840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).