N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine

C11H21N — CID 81033644

IUPACN-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine
SMILESC=C(C)CC1CCCC1CNC
InChIInChI=1S/C11H21N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h10-12H,1,4-8H2,2-3H3
InChIKeyNTQQRNBXAKCYRB-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.59
Rot. Bonds4

About N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine

N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine (PubChem CID 81033644) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine
PubChem CID81033644
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine
SMILESC=C(C)CC1CCCC1CNC
InChIInChI=1S/C11H21N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h10-12H,1,4-8H2,2-3H3
InChIKeyNTQQRNBXAKCYRB-UHFFFAOYSA-N
XLogP2.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]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-(2-methylprop-2-enyl)cyclopentyl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine (CID 81033644) is N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine is C=C(C)CC1CCCC1CNC.
What is the InChIKey of N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine?
The InChIKey is NTQQRNBXAKCYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9(2)7-10-5-4-6-11(10)8-12-3/h10-12H,1,4-8H2,2-3H3.
What are the key properties of N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine?
N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine has a molecular weight of 167.30 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylprop-2-enyl)cyclopentyl]methanamine is sourced from PubChem (CID 81033644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).