3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide

C12H18N2O2S — CID 51083633

IUPAC3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1C)c1cccs1
InChIInChI=1S/C12H18N2O2S/c1-9-8-16-6-5-14(9)12(15)13-10(2)11-4-3-7-17-11/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyRYHPLGPXHBFHFH-UHFFFAOYSA-N
MW254.35 g/mol
LogP2.24
Rot. Bonds2

About 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide

3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide (PubChem CID 51083633) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide
PubChem CID51083633
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide
SMILESCC(NC(=O)N1CCOCC1C)c1cccs1
InChIInChI=1S/C12H18N2O2S/c1-9-8-16-6-5-14(9)12(15)13-10(2)11-4-3-7-17-11/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyRYHPLGPXHBFHFH-UHFFFAOYSA-N
XLogP2.24
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(1-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 115583183
N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-3-methylmorpholine-4-carboxamide
CID 71940598
(3R)-N-[(1R)-1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-3-methylmorpholine-4-carboxamide
CID 94110131
3-methyl-N-[1-(5-methylthiophen-2-yl)propan-2-yl]morpholine-4-carboxamide
CID 86768543
(3S)-3-methyl-N-[(2S)-1-(5-methylthiophen-2-yl)propan-2-yl]morpholine-4-carboxamide
CID 95774049
3-methyl-N-propan-2-yl-1,4-oxazepane-4-carboxamide
CID 130834986
3-methyl-N-phenylmorpholine-4-carboxamide
CID 47166676
(3R)-3-methyl-N-phenylmorpholine-4-carboxamide
CID 38887206
(3S)-3-methyl-N-phenylmorpholine-4-carboxamide
CID 38887208
N-[(1S)-1-thiophen-2-ylethyl]oxane-4-carboxamide
CID 30971824
1-[(2R)-2-morpholin-4-ylpropyl]-3-[(1S)-1-thiophen-2-ylethyl]urea
CID 94028317
2-[[2-(hydroxymethyl)-5-methylmorpholine-4-carbonyl]amino]-2-thiophen-2-ylacetic acid
CID 115285671

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide?
The IUPAC name of 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide (CID 51083633) is 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide.
What is the SMILES notation for 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide?
The canonical SMILES for 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide is CC(NC(=O)N1CCOCC1C)c1cccs1.
What is the InChIKey of 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide?
The InChIKey is RYHPLGPXHBFHFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-9-8-16-6-5-14(9)12(15)13-10(2)11-4-3-7-17-11/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,13,15).
What are the key properties of 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide?
3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide is sourced from PubChem (CID 51083633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).