trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine

C13H26N2O — CID 784558

IUPACtrans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
SMILESC[C@H]1CCC[C@H](NCCN2CCOCC2)C1
InChIInChI=1S/C13H26N2O/c1-12-3-2-4-13(11-12)14-5-6-15-7-9-16-10-8-15/h12-14H,2-11H2,1H3/t12-,13-/m0/s1
InChIKeyOLZAXJVRHIMHKT-STQMWFEESA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine

trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine (PubChem CID 784558) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Nametrans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
PubChem CID784558
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Nametrans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
SMILESC[C@H]1CCC[C@H](NCCN2CCOCC2)C1
InChIInChI=1S/C13H26N2O/c1-12-3-2-4-13(11-12)14-5-6-15-7-9-16-10-8-15/h12-14H,2-11H2,1H3/t12-,13-/m0/s1
InChIKeyOLZAXJVRHIMHKT-STQMWFEESA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)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

(1-(Morpholin-4-yl)cyclohexyl)methanamine
CID 3157486
1-(Morpholin-4-ylmethyl)cyclohexanamine
CID 6484225
3-Ethyl-2-(morpholin-4-yl)pentan-1-amine
CID 16228000
4-tert-butyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 758268
Cambridge id 5413011
CID 782064
4-Ethyl-N-(3-morpholinopropyl)cyclohexan-1-amine
CID 2058130
4-methyl-N-(3-morpholin-4-ylpropyl)cyclohexan-1-amine
CID 2846678
[1-(2,2-Dimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 43592696
rac-[(1R,2R)-2-(morpholin-4-yl)cyclohexyl]methanamine dihydrochloride
CID 137838601
4-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 784225
Cambridge id 5460896
CID 2846537
3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 2846685

Frequently Asked Questions

What is the IUPAC name of trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine?
The IUPAC name of trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine (CID 784558) is trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine?
The canonical SMILES for trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine is C[C@H]1CCC[C@H](NCCN2CCOCC2)C1.
What is the InChIKey of trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine?
The InChIKey is OLZAXJVRHIMHKT-STQMWFEESA-N. The full InChI is InChI=1S/C13H26N2O/c1-12-3-2-4-13(11-12)14-5-6-15-7-9-16-10-8-15/h12-14H,2-11H2,1H3/t12-,13-/m0/s1.
What are the key properties of trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine?
trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,3S)-3-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 784558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).