N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine

C11H20N2 — CID 167158757

IUPACN-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine
SMILESC=NC1CCCCC1NC1CCC1
InChIInChI=1S/C11H20N2/c1-12-10-7-2-3-8-11(10)13-9-5-4-6-9/h9-11,13H,1-8H2
InChIKeyJNTKLPUGUSKSTG-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.14
Rot. Bonds3

About N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine

N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine (PubChem CID 167158757) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine.

Molecular Properties

Compound NameN-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine
PubChem CID167158757
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC NameN-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine
SMILESC=NC1CCCCC1NC1CCC1
InChIInChI=1S/C11H20N2/c1-12-10-7-2-3-8-11(10)13-9-5-4-6-9/h9-11,13H,1-8H2
InChIKeyJNTKLPUGUSKSTG-UHFFFAOYSA-N
XLogP2.14
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-cyclobutyl-2-(methylideneamino)cyclohexan-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

Related Compounds

cis-(1S,2R)-2-(cyclobutylamino)cyclohexan-1-ol
CID 94414916
trans-(1R,2R)-N-cyclobutyl-2-fluorocyclohexan-1-amine
CID 126847798
cis-(1S,2R)-2-(methylideneamino)-N-propylcycloheptan-1-amine
CID 167296625
N-(2-cycloundecylcyclopentyl)cycloundecanamine
CID 146492936
N-(2-cyclononylcyclopentyl)cycloundecanamine
CID 167283345
N-(2-chlorocyclopentyl)cycloheptanamine
CID 127002051
2-(cycloheptylamino)cyclopentan-1-ol
CID 60713716
N-(2-cyclononylcyclopentyl)cyclododecanamine
CID 146530332
N-[(1R,2R)-2-fluorocyclopentyl]cyclohexanamine
CID 126847823
2-(cyclopentylamino)cyclopentane-1-carbonitrile
CID 62742199
1-N-cyclopentylcycloheptane-1,2-diamine
CID 82933043
N-cyclohexylmethanimine;1,2-dicyclohexylhydrazine
CID 144690483

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine?
The IUPAC name of N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine (CID 167158757) is N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine.
What is the SMILES notation for N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine?
The canonical SMILES for N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine is C=NC1CCCCC1NC1CCC1.
What is the InChIKey of N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine?
The InChIKey is JNTKLPUGUSKSTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-12-10-7-2-3-8-11(10)13-9-5-4-6-9/h9-11,13H,1-8H2.
What are the key properties of N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine?
N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine has a molecular weight of 180.29 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-(methylideneamino)cyclohexan-1-amine is sourced from PubChem (CID 167158757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).