2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide

C16H26N2O2S — CID 7110530

IUPAC2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide
SMILESC[C@H](NC(=O)C(C)(C)C)[C@@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C16H26N2O2S/c1-12(17-15(19)16(2,3)4)14(13-6-5-11-21-13)18-7-9-20-10-8-18/h5-6,11-12,14H,7-10H2,1-4H3,(H,17,19)/t12-,14-/m0/s1
InChIKeyCUWYYTZWBWMQCD-JSGCOSHPSA-N
MW310.46 g/mol
LogP2.67
Rot. Bonds4

About 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide

2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide (PubChem CID 7110530) has the molecular formula C16H26N2O2S and a molecular weight of 310.46 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide
PubChem CID7110530
Molecular FormulaC16H26N2O2S
Molecular Weight310.46 g/mol
Exact Mass310.17
IUPAC Name2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide
SMILESC[C@H](NC(=O)C(C)(C)C)[C@@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C16H26N2O2S/c1-12(17-15(19)16(2,3)4)14(13-6-5-11-21-13)18-7-9-20-10-8-18/h5-6,11-12,14H,7-10H2,1-4H3,(H,17,19)/t12-,14-/m0/s1
InChIKeyCUWYYTZWBWMQCD-JSGCOSHPSA-N
XLogP2.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.46
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide with MolForge

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Related Compounds

N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
CID 29181274
phenyl N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)carbamate
CID 3239939
phenyl N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]carbamate
CID 28820776
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)pyridine-3-carboxamide
CID 3241321
1-(4-chlorophenyl)-3-[(1S,2R)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]urea
CID 7111013
2-methoxy-N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)benzamide
CID 3238588
4-ethoxy-N-[(1R,2R)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]benzamide
CID 7110616
4-ethoxy-N-[(1R,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]benzamide
CID 7110612
N-[(4-fluorophenyl)methyl]-N'-[(1R,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]oxamide
CID 92665747
N-[(2-chlorophenyl)methyl]-N'-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]oxamide
CID 7110520
N-[(2-chlorophenyl)methyl]-N'-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)oxamide
CID 16806516
N-[(1R,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]benzenesulfonamide
CID 7110846

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide (CID 7110530) is 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide is C[C@H](NC(=O)C(C)(C)C)[C@@H](c1cccs1)N1CCOCC1.
What is the InChIKey of 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide?
The InChIKey is CUWYYTZWBWMQCD-JSGCOSHPSA-N. The full InChI is InChI=1S/C16H26N2O2S/c1-12(17-15(19)16(2,3)4)14(13-6-5-11-21-13)18-7-9-20-10-8-18/h5-6,11-12,14H,7-10H2,1-4H3,(H,17,19)/t12-,14-/m0/s1.
What are the key properties of 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide?
2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide has a molecular weight of 310.46 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide is sourced from PubChem (CID 7110530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).