4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide

C14H25N3O3 — CID 83099425

IUPAC4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(=O)C1CCC(CN)CC1
InChIInChI=1S/C14H25N3O3/c1-16-13(18)12-9-20-7-6-17(12)14(19)11-4-2-10(8-15)3-5-11/h10-12H,2-9,15H2,1H3,(H,16,18)
InChIKeyAGPALQRXGJDHHY-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.28
Rot. Bonds3

About 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide

4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide (PubChem CID 83099425) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide
PubChem CID83099425
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(=O)C1CCC(CN)CC1
InChIInChI=1S/C14H25N3O3/c1-16-13(18)12-9-20-7-6-17(12)14(19)11-4-2-10(8-15)3-5-11/h10-12H,2-9,15H2,1H3,(H,16,18)
InChIKeyAGPALQRXGJDHHY-UHFFFAOYSA-N
XLogP-0.28
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide 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

4-[3-(methylcarbamoyl)morpholine-4-carbonyl]cyclohexane-1-carboxylic acid
CID 83104998
4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide
CID 83098008
4-(4-amino-3-methylcyclohexanecarbonyl)-N-methylmorpholine-3-carboxamide
CID 83104925
4-[2-(4-aminopiperidin-1-yl)acetyl]-N-methylmorpholine-3-carboxamide
CID 83099577
4-(2-aminocycloheptanecarbonyl)-N-methylmorpholine-3-carboxamide
CID 83098853
(2R,5S)-5-[3-(methylcarbamoyl)morpholine-4-carbonyl]oxolane-2-carboxylic acid
CID 102945606
N-methyl-4-(3-oxobutanoyl)morpholine-3-carboxamide
CID 83097475
methyl 3-(methylcarbamoyl)morpholine-4-carboxylate
CID 116657428
4-butanoyl-N-methylmorpholine-3-carboxamide
CID 83104060
4-[3-(aminomethyl)cyclohexanecarbonyl]morpholine-3-carboxamide
CID 83095299
4-(2,2-dimethylpropanoyl)-N-methylmorpholine-3-carboxamide
CID 83105243
(4-aminocyclohexyl)-(3-ethylmorpholin-4-yl)methanone
CID 60847443

Frequently Asked Questions

What is the IUPAC name of 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide (CID 83099425) is 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide is CNC(=O)C1COCCN1C(=O)C1CCC(CN)CC1.
What is the InChIKey of 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide?
The InChIKey is AGPALQRXGJDHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-16-13(18)12-9-20-7-6-17(12)14(19)11-4-2-10(8-15)3-5-11/h10-12H,2-9,15H2,1H3,(H,16,18).
What are the key properties of 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide?
4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide has a molecular weight of 283.37 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83099425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).