N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide

C12H18N2O2S — CID 115589977

IUPACN-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide
SMILESCC(Cc1ccsc1)NC(=O)N1CCOCC1
InChIInChI=1S/C12H18N2O2S/c1-10(8-11-2-7-17-9-11)13-12(15)14-3-5-16-6-4-14/h2,7,9-10H,3-6,8H2,1H3,(H,13,15)
InChIKeyGLPVTCSKCXTPGN-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.72
Rot. Bonds3

About N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide

N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide (PubChem CID 115589977) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide
PubChem CID115589977
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide
SMILESCC(Cc1ccsc1)NC(=O)N1CCOCC1
InChIInChI=1S/C12H18N2O2S/c1-10(8-11-2-7-17-9-11)13-12(15)14-3-5-16-6-4-14/h2,7,9-10H,3-6,8H2,1H3,(H,13,15)
InChIKeyGLPVTCSKCXTPGN-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-[[4-(dimethylamino)oxan-4-yl]methyl]-3-[(2R)-1-thiophen-3-ylpropan-2-yl]urea
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N-(1-thiophen-3-ylpropan-2-yl)imidazole-1-carboxamide
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6-methyl-N-(1-thiophen-3-ylpropan-2-yl)-3,4-dihydro-2H-pyran-5-carboxamide
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1-(1,3-dihydro-2-benzofuran-5-yl)-3-[(2S)-1-thiophen-3-ylpropan-2-yl]urea
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(2S)-2-amino-3-methyl-N-(1-thiophen-3-ylpropan-2-yl)butanamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide (CID 115589977) is N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide is CC(Cc1ccsc1)NC(=O)N1CCOCC1.
What is the InChIKey of N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide?
The InChIKey is GLPVTCSKCXTPGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-10(8-11-2-7-17-9-11)13-12(15)14-3-5-16-6-4-14/h2,7,9-10H,3-6,8H2,1H3,(H,13,15).
What are the key properties of N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide?
N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-3-ylpropan-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 115589977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).