N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide

C15H28FN3O2 — CID 69469521

IUPACN-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNC[C@H](CC1CCC(F)CC1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H28FN3O2/c1-17-11-14(10-12-2-4-13(16)5-3-12)18-15(20)19-6-8-21-9-7-19/h12-14,17H,2-11H2,1H3,(H,18,20)/t12?,13?,14-/m0/s1
InChIKeyXAWCALKCONCCAN-RUXDESIVSA-N
MW301.41 g/mol
LogP1.53
Rot. Bonds5

About N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide

N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (PubChem CID 69469521) has the molecular formula C15H28FN3O2 and a molecular weight of 301.41 g/mol. Its IUPAC name is N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
PubChem CID69469521
Molecular FormulaC15H28FN3O2
Molecular Weight301.41 g/mol
Exact Mass301.22
IUPAC NameN-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNC[C@H](CC1CCC(F)CC1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H28FN3O2/c1-17-11-14(10-12-2-4-13(16)5-3-12)18-15(20)19-6-8-21-9-7-19/h12-14,17H,2-11H2,1H3,(H,18,20)/t12?,13?,14-/m0/s1
InChIKeyXAWCALKCONCCAN-RUXDESIVSA-N
XLogP1.53
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-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

Urea, N-cyclohexyl-N'-[2-(4-morpholinyl)ethyl]-
CID 1086741
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2,3-dimethylpiperidine-1-carboxamide
CID 75512356
2-ethyl-N-(2-ethylcyclohexyl)-6-methylmorpholine-4-carboxamide
CID 91642614
1-butyl-3-[[(1S,2S)-2-morpholin-4-ylcyclohexyl]methyl]urea
CID 136585215
N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]piperidine-1-carboxamide
CID 67198553
N-[1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]piperidine-1-carboxamide
CID 77238978
N-[2-[3-[(4-fluoro-4-methylcyclohexyl)methyl]morpholin-4-yl]ethyl]formamide
CID 123837338
N-[1-[5,5-difluoro-1-(propan-2-ylcarbamoyl)piperidin-3-yl]propan-2-yl]morpholine-4-carboxamide
CID 129106701
3-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
CID 145730619
[1-(Ethylcarbamoyl)-2-[[4-(trifluoromethyl)cyclohexyl]oxymethyl]piperidin-3-yl]azanium
CID 163481423
(2R,3S)-3-amino-N-ethyl-2-[[4-(trifluoromethyl)cyclohexyl]oxymethyl]piperidine-1-carboxamide
CID 166854308
1-[(1R,2R)-2-ethylcyclohexyl]-3-(3-morpholin-4-ylpropyl)urea
CID 134839214

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The IUPAC name of N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (CID 69469521) is N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The canonical SMILES for N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is CNC[C@H](CC1CCC(F)CC1)NC(=O)N1CCOCC1.
What is the InChIKey of N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The InChIKey is XAWCALKCONCCAN-RUXDESIVSA-N. The full InChI is InChI=1S/C15H28FN3O2/c1-17-11-14(10-12-2-4-13(16)5-3-12)18-15(20)19-6-8-21-9-7-19/h12-14,17H,2-11H2,1H3,(H,18,20)/t12?,13?,14-/m0/s1.
What are the key properties of N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide has a molecular weight of 301.41 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-(4-fluorocyclohexyl)-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is sourced from PubChem (CID 69469521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).