1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine

C7H14ClN — CID 130744589

IUPAC1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1(CCl)CCC1
InChIInChI=1S/C7H14ClN/c1-9-6-7(5-8)3-2-4-7/h9H,2-6H2,1H3
InChIKeyPSORWGBTVQRSGK-UHFFFAOYSA-N
MW147.65 g/mol
LogP1.61
Rot. Bonds3

About 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine

1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine (PubChem CID 130744589) has the molecular formula C7H14ClN and a molecular weight of 147.65 g/mol. Its IUPAC name is 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine
PubChem CID130744589
Molecular FormulaC7H14ClN
Molecular Weight147.65 g/mol
Exact Mass147.08
IUPAC Name1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine
SMILESCNCC1(CCl)CCC1
InChIInChI=1S/C7H14ClN/c1-9-6-7(5-8)3-2-4-7/h9H,2-6H2,1H3
InChIKeyPSORWGBTVQRSGK-UHFFFAOYSA-N
XLogP1.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.65
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine 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

1-[3-(chloromethyl)oxolan-3-yl]-N-methylmethanamine
CID 130640166
1-[1-(2-ethylbutyl)cyclobutyl]-N-methylmethanamine
CID 82930955
N-methyl-1-(1-prop-2-enylcyclobutyl)methanamine
CID 130672837
1-[1-(2-methoxyethyl)cyclobutyl]-N-methylmethanamine
CID 65194306
N-[[1-(chloromethyl)cyclopentyl]methyl]-3-methylbut-2-en-1-amine
CID 107901161
N-[[1-(chloromethyl)cyclopentyl]methyl]-2,2-difluoroethanamine
CID 115363272
N-methyl-1-[1-(4-methylpentyl)cyclobutyl]methanamine
CID 83168798
N-[[1-(chloromethyl)cyclopentyl]methyl]-4-methoxybutan-1-amine
CID 104649791
1-(1-ethylcyclohexyl)-N-methylmethanamine;formaldehyde
CID 143085262
1-[1-(3-ethylsulfonylpropyl)cyclobutyl]-N-methylmethanamine
CID 65194813
N-[[1-(chloromethyl)cyclopentyl]methyl]-1-cyclohexylmethanamine
CID 115363404
N-[[1-(chloromethyl)cyclopentyl]methyl]-3,3,3-trifluoropropan-1-amine
CID 115363319

Frequently Asked Questions

What is the IUPAC name of 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine?
The IUPAC name of 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine (CID 130744589) is 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine is CNCC1(CCl)CCC1.
What is the InChIKey of 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine?
The InChIKey is PSORWGBTVQRSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14ClN/c1-9-6-7(5-8)3-2-4-7/h9H,2-6H2,1H3.
What are the key properties of 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine?
1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine has a molecular weight of 147.65 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(chloromethyl)cyclobutyl]-N-methylmethanamine is sourced from PubChem (CID 130744589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).