(1-methyl-3-methylidenecyclobutyl)methanamine

C7H13N — CID 55289603

IUPAC(1-methyl-3-methylidenecyclobutyl)methanamine
SMILESC=C1CC(C)(CN)C1
InChIInChI=1S/C7H13N/c1-6-3-7(2,4-6)5-8/h1,3-5,8H2,2H3
InChIKeyCTSCFINQELVYFF-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.30
Rot. Bonds1

About (1-methyl-3-methylidenecyclobutyl)methanamine

(1-methyl-3-methylidenecyclobutyl)methanamine (PubChem CID 55289603) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is (1-methyl-3-methylidenecyclobutyl)methanamine.

Molecular Properties

Compound Name(1-methyl-3-methylidenecyclobutyl)methanamine
PubChem CID55289603
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name(1-methyl-3-methylidenecyclobutyl)methanamine
SMILESC=C1CC(C)(CN)C1
InChIInChI=1S/C7H13N/c1-6-3-7(2,4-6)5-8/h1,3-5,8H2,2H3
InChIKeyCTSCFINQELVYFF-UHFFFAOYSA-N
XLogP1.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1-methyl-3-methylidenecyclobutyl)methanamine 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

2,2,4-Trimethylpent-4-en-1-amine
CID 15357083
1-[1-(Difluoromethyl)-3-methylidenecyclobutyl]methanamine
CID 155973650
1-[1-(Prop-1-en-2-yl)cyclobutyl]methanamine
CID 89275815
2-(Aminomethyl)-4,4-dimethylpent-1-ene
CID 117266454
(1-Ethenylcyclobutyl)methanamine
CID 138991466
2,2,4-Trimethylhexa-4,5-dien-1-amine
CID 139399147
2,2-Dimethyl-4-methylidenecyclobutan-1-amine
CID 163815231
(1,3-Dimethylcyclobut-2-en-1-yl)methanamine
CID 23264406
(2,2-Dimethyl-3-methylidenecyclobutyl)methanamine
CID 55291242
2,2,4-Trimethylpent-4-en-1-amine hydrochloride
CID 122240247
[1-(2-Methylprop-2-enyl)cyclobutyl]methanamine
CID 130514783
[1-(2-Methylidenebutyl)cyclobutyl]methanamine
CID 130514812

Frequently Asked Questions

What is the IUPAC name of (1-methyl-3-methylidenecyclobutyl)methanamine?
The IUPAC name of (1-methyl-3-methylidenecyclobutyl)methanamine (CID 55289603) is (1-methyl-3-methylidenecyclobutyl)methanamine.
What is the SMILES notation for (1-methyl-3-methylidenecyclobutyl)methanamine?
The canonical SMILES for (1-methyl-3-methylidenecyclobutyl)methanamine is C=C1CC(C)(CN)C1.
What is the InChIKey of (1-methyl-3-methylidenecyclobutyl)methanamine?
The InChIKey is CTSCFINQELVYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-6-3-7(2,4-6)5-8/h1,3-5,8H2,2H3.
What are the key properties of (1-methyl-3-methylidenecyclobutyl)methanamine?
(1-methyl-3-methylidenecyclobutyl)methanamine has a molecular weight of 111.19 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-3-methylidenecyclobutyl)methanamine is sourced from PubChem (CID 55289603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).