6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine

C14H28N2O — CID 91427984

IUPAC6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine
SMILESCCC1CC(CNCC2CCC(N)C(C)O2)C1
InChIInChI=1S/C14H28N2O/c1-3-11-6-12(7-11)8-16-9-13-4-5-14(15)10(2)17-13/h10-14,16H,3-9,15H2,1-2H3
InChIKeyNWDGAMSSUZEJMW-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.91
Rot. Bonds5

About 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine

6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine (PubChem CID 91427984) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine.

Molecular Properties

Compound Name6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine
PubChem CID91427984
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine
SMILESCCC1CC(CNCC2CCC(N)C(C)O2)C1
InChIInChI=1S/C14H28N2O/c1-3-11-6-12(7-11)8-16-9-13-4-5-14(15)10(2)17-13/h10-14,16H,3-9,15H2,1-2H3
InChIKeyNWDGAMSSUZEJMW-UHFFFAOYSA-N
XLogP1.91
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-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

3-(Cyclobutylmethyl)morpholine
CID 116927993
5-fluoro-N,2,4,6-tetramethyloxan-3-amine
CID 59938453
N-[(3-fluoro-3-methylcyclobutyl)methyl]oxan-3-amine
CID 170209763
N-(2-Oxa-9-azaspiro[5.5]undecan-3-ylmethyl)-N-methylpropan-2-amine
CID 121229712
2-Hexan-2-ylmorpholine
CID 18331948
1-methoxy-N-methyl-3-piperidin-4-ylpropan-2-amine
CID 20646568
1-cyclohexyl-N-(oxan-2-ylmethyl)methanamine
CID 22180617
N-ethyl-2,6-dimethyloxan-3-amine
CID 22969198
N-(1-cyclohexyl-2-propan-2-yloxyethyl)propan-2-amine
CID 58384613
2-Methyl-6-(methylaminomethyl)oxan-3-amine
CID 59072013
N,2-dimethyl-6-propan-2-yloxan-3-amine
CID 59423660
(2R,3R,6S)-2-methyl-6-(methylaminomethyl)oxan-3-amine
CID 60076898

Frequently Asked Questions

What is the IUPAC name of 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine?
The IUPAC name of 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine (CID 91427984) is 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine.
What is the SMILES notation for 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine?
The canonical SMILES for 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine is CCC1CC(CNCC2CCC(N)C(C)O2)C1.
What is the InChIKey of 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine?
The InChIKey is NWDGAMSSUZEJMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-11-6-12(7-11)8-16-9-13-4-5-14(15)10(2)17-13/h10-14,16H,3-9,15H2,1-2H3.
What are the key properties of 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine?
6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine has a molecular weight of 240.39 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(3-ethylcyclobutyl)methylamino]methyl]-2-methyloxan-3-amine is sourced from PubChem (CID 91427984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).