N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine

C11H23N — CID 66026435

IUPACN-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1(CCC(C)C)CC1
InChIInChI=1S/C11H23N/c1-4-12-9-11(7-8-11)6-5-10(2)3/h10,12H,4-9H2,1-3H3
InChIKeyOVTSXUDXVZSYFY-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.81
Rot. Bonds6

About N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine

N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine (PubChem CID 66026435) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine
PubChem CID66026435
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine
SMILESCCNCC1(CCC(C)C)CC1
InChIInChI=1S/C11H23N/c1-4-12-9-11(7-8-11)6-5-10(2)3/h10,12H,4-9H2,1-3H3
InChIKeyOVTSXUDXVZSYFY-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine 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

N-[[1-(4-methylpentyl)cyclopropyl]methyl]ethanamine
CID 83169408
N-[[1-(3-methylbutyl)cyclohexyl]methyl]propan-1-amine
CID 63509381
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-4-methylpentan-1-amine
CID 114757500
N-[[1-(ethylaminomethyl)cyclopentyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 63493661
N-methyl-1-[4-(3-methylbutyl)oxan-4-yl]methanamine
CID 62905014
N-[(1-ethylcyclobutyl)methyl]ethanamine
CID 65194759
N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
CID 106457012
N-methyl-1-[1-(4-methylpentyl)cyclobutyl]methanamine
CID 83168798
N-[[1-(4-methylpentyl)cyclopentyl]methyl]propan-1-amine
CID 83167921
N-[[1-(2-propan-2-ylsulfonylethyl)cyclopentyl]methyl]ethanamine
CID 106729871
N'-[[1-(ethylaminomethyl)cyclopentyl]methyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 62255885
N-[(1-octylcyclobutyl)methyl]ethanamine
CID 65194537

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine (CID 66026435) is N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine is CCNCC1(CCC(C)C)CC1.
What is the InChIKey of N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine?
The InChIKey is OVTSXUDXVZSYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-12-9-11(7-8-11)6-5-10(2)3/h10,12H,4-9H2,1-3H3.
What are the key properties of N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine?
N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine has a molecular weight of 169.31 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 66026435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).