N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine

C10H19N — CID 91157465

IUPACN-methyl-3-prop-1-en-2-ylcyclohexan-1-amine
SMILESC=C(C)C1CCCC(NC)C1
InChIInChI=1S/C10H19N/c1-8(2)9-5-4-6-10(7-9)11-3/h9-11H,1,4-7H2,2-3H3
InChIKeyJUVJLLWGMDHTCG-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.34
Rot. Bonds2

About N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine

N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine (PubChem CID 91157465) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-3-prop-1-en-2-ylcyclohexan-1-amine
PubChem CID91157465
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-methyl-3-prop-1-en-2-ylcyclohexan-1-amine
SMILESC=C(C)C1CCCC(NC)C1
InChIInChI=1S/C10H19N/c1-8(2)9-5-4-6-10(7-9)11-3/h9-11H,1,4-7H2,2-3H3
InChIKeyJUVJLLWGMDHTCG-UHFFFAOYSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine 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-3-prop-1-en-2-ylcyclohexan-1-amine?
The IUPAC name of N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine (CID 91157465) is N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine.
What is the SMILES notation for N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine?
The canonical SMILES for N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine is C=C(C)C1CCCC(NC)C1.
What is the InChIKey of N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine?
The InChIKey is JUVJLLWGMDHTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8(2)9-5-4-6-10(7-9)11-3/h9-11H,1,4-7H2,2-3H3.
What are the key properties of N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine?
N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-prop-1-en-2-ylcyclohexan-1-amine is sourced from PubChem (CID 91157465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).