N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide

C16H20N2O3S — CID 29181274

IUPACN-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
SMILESC[C@H](NC(=O)c1ccco1)[C@@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C16H20N2O3S/c1-12(17-16(19)13-4-2-8-21-13)15(14-5-3-11-22-14)18-6-9-20-10-7-18/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,17,19)/t12-,15-/m0/s1
InChIKeyCSTWPNCFDRGOBF-WFASDCNBSA-N
MW320.41 g/mol
LogP2.53
Rot. Bonds5

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

N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide (PubChem CID 29181274) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
PubChem CID29181274
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC NameN-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
SMILESC[C@H](NC(=O)c1ccco1)[C@@H](c1cccs1)N1CCOCC1
InChIInChI=1S/C16H20N2O3S/c1-12(17-16(19)13-4-2-8-21-13)15(14-5-3-11-22-14)18-6-9-20-10-7-18/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,17,19)/t12-,15-/m0/s1
InChIKeyCSTWPNCFDRGOBF-WFASDCNBSA-N
XLogP2.53
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S,2R)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
CID 92666028
2,2-dimethyl-N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]propanamide
CID 7110530
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)pyridine-3-carboxamide
CID 3241321
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
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
1-(4-chlorophenyl)-3-[(1S,2R)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]urea
CID 7111013
N-[(4-fluorophenyl)methyl]-N'-[(1R,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]oxamide
CID 92665747
N'-[(1S,2R)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]-N-(pyridin-3-ylmethyl)oxamide
CID 92665752
N-[(1S,2S)-1-(4-benzylpiperazin-1-yl)-1-thiophen-2-ylpropan-2-yl]benzamide
CID 7110824

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide (CID 29181274) is N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide is C[C@H](NC(=O)c1ccco1)[C@@H](c1cccs1)N1CCOCC1.
What is the InChIKey of N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide?
The InChIKey is CSTWPNCFDRGOBF-WFASDCNBSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-12(17-16(19)13-4-2-8-21-13)15(14-5-3-11-22-14)18-6-9-20-10-7-18/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,17,19)/t12-,15-/m0/s1.
What are the key properties of N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide?
N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide has a molecular weight of 320.41 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 29181274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).