(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide

C16H30N4O3 — CID 51980815

IUPAC(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide
SMILESCNC(=O)NC(=O)[C@H](C)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H30N4O3/c1-13(14(21)19-15(22)17-2)18-12-16(6-4-3-5-7-16)20-8-10-23-11-9-20/h13,18H,3-12H2,1-2H3,(H2,17,19,21,22)/t13-/m0/s1
InChIKeyTWPVDSZRXKPZAA-ZDUSSCGKSA-N
MW326.44 g/mol
LogP0.46
Rot. Bonds5

About (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide

(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide (PubChem CID 51980815) has the molecular formula C16H30N4O3 and a molecular weight of 326.44 g/mol. Its IUPAC name is (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide.

Molecular Properties

Compound Name(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide
PubChem CID51980815
Molecular FormulaC16H30N4O3
Molecular Weight326.44 g/mol
Exact Mass326.23
IUPAC Name(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide
SMILESCNC(=O)NC(=O)[C@H](C)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H30N4O3/c1-13(14(21)19-15(22)17-2)18-12-16(6-4-3-5-7-16)20-8-10-23-11-9-20/h13,18H,3-12H2,1-2H3,(H2,17,19,21,22)/t13-/m0/s1
InChIKeyTWPVDSZRXKPZAA-ZDUSSCGKSA-N
XLogP0.46
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide 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

(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 51715596
(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
CID 56875780
2-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
CID 78789816
(2S)-1-methoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]propan-2-amine
CID 95132389
N-(methylcarbamoyl)-2-[(2-methylthiolan-2-yl)methylamino]propanamide
CID 80527987
N-(methylcarbamoyl)-2-[(1-methylsulfanylcyclopropyl)methylamino]propanamide
CID 107266190
N-[(2R)-1-[(1-morpholin-4-ylcyclohexyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 31328196
2-amino-3-methoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 120983514
2-[(1-hydroxy-4,4-dimethylcyclohexyl)methylamino]-N-(methylcarbamoyl)propanamide
CID 65120855
(2R)-2-[[2-(1-morpholin-4-ylcyclopentyl)acetyl]amino]propanoic acid
CID 119369700
2-[[2-(1-morpholin-4-ylcyclopentyl)acetyl]amino]propanoic acid
CID 119348520
3,3-dimethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
CID 78789271

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide?
The IUPAC name of (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide (CID 51980815) is (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide.
What is the SMILES notation for (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide?
The canonical SMILES for (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide is CNC(=O)NC(=O)[C@H](C)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide?
The InChIKey is TWPVDSZRXKPZAA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H30N4O3/c1-13(14(21)19-15(22)17-2)18-12-16(6-4-3-5-7-16)20-8-10-23-11-9-20/h13,18H,3-12H2,1-2H3,(H2,17,19,21,22)/t13-/m0/s1.
What are the key properties of (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide?
(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide has a molecular weight of 326.44 g/mol, XLogP of 0.46, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide is sourced from PubChem (CID 51980815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).