[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone

C14H26N2O2 — CID 113310457

IUPAC[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone
SMILESCC1CCC(CN)(C(=O)N2CCOCC2C)CC1
InChIInChI=1S/C14H26N2O2/c1-11-3-5-14(10-15,6-4-11)13(17)16-7-8-18-9-12(16)2/h11-12H,3-10,15H2,1-2H3
InChIKeySPQCWAMPJYTCBO-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.39
Rot. Bonds2

About [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone

[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone (PubChem CID 113310457) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone
PubChem CID113310457
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone
SMILESCC1CCC(CN)(C(=O)N2CCOCC2C)CC1
InChIInChI=1S/C14H26N2O2/c1-11-3-5-14(10-15,6-4-11)13(17)16-7-8-18-9-12(16)2/h11-12H,3-10,15H2,1-2H3
InChIKeySPQCWAMPJYTCBO-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone 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-(aminomethyl)cyclopropyl]-(3-methylmorpholin-4-yl)methanone
CID 80588742
[1-(aminomethyl)-4-methylcyclohexyl]-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]methanone
CID 115442462
(3-ethylpyrrolidin-3-yl)-(3-methylmorpholin-4-yl)methanone
CID 63138588
2-[4-[1-(aminomethyl)cyclobutanecarbonyl]morpholin-3-yl]acetic acid
CID 113311756
4-amino-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
CID 93111675
[1-(aminomethyl)-4-methylcyclohexyl]-(oxan-3-yl)methanone
CID 107138477
[1-(aminomethyl)-4-methylcyclohexyl]-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106669058
[1-(aminomethyl)cyclobutyl]-(2-methylazepan-1-yl)methanone
CID 80599736
[4-(aminomethyl)oxan-4-yl]-(2,3-dimethylpyrrolidin-1-yl)methanone;hydrochloride
CID 120937073
6-amino-1-[(3R)-3-methylmorpholin-4-yl]hexan-1-one
CID 106774401
3-methyl-1-(3-methylmorpholine-4-carbonyl)cyclobutane-1-carbonitrile
CID 80599333
4-[1-(aminomethyl)-3-methylcyclobutanecarbonyl]-N-propan-2-ylmorpholine-3-carboxamide
CID 83098809

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone (CID 113310457) is [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone is CC1CCC(CN)(C(=O)N2CCOCC2C)CC1.
What is the InChIKey of [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone?
The InChIKey is SPQCWAMPJYTCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-3-5-14(10-15,6-4-11)13(17)16-7-8-18-9-12(16)2/h11-12H,3-10,15H2,1-2H3.
What are the key properties of [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone?
[1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone has a molecular weight of 254.37 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)-4-methylcyclohexyl]-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 113310457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).