N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine

C8H15N3 — CID 63108982

IUPACN-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
SMILESCCCc1ncc(CNC)[nH]1
InChIInChI=1S/C8H15N3/c1-3-4-8-10-6-7(11-8)5-9-2/h6,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyUCGWKZPXMNQTNH-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.08
Rot. Bonds4

About N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine

N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine (PubChem CID 63108982) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
PubChem CID63108982
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
SMILESCCCc1ncc(CNC)[nH]1
InChIInChI=1S/C8H15N3/c1-3-4-8-10-6-7(11-8)5-9-2/h6,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyUCGWKZPXMNQTNH-UHFFFAOYSA-N
XLogP1.08
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine (CID 63108982) is N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine is CCCc1ncc(CNC)[nH]1.
What is the InChIKey of N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine?
The InChIKey is UCGWKZPXMNQTNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-4-8-10-6-7(11-8)5-9-2/h6,9H,3-5H2,1-2H3,(H,10,11).
What are the key properties of N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine?
N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine has a molecular weight of 153.23 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine is sourced from PubChem (CID 63108982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).