3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide

C12H18N2O2S — CID 68502987

IUPAC3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESNC(=O)c1sccc1CCCN1CCOCC1
InChIInChI=1S/C12H18N2O2S/c13-12(15)11-10(3-9-17-11)2-1-4-14-5-7-16-8-6-14/h3,9H,1-2,4-8H2,(H2,13,15)
InChIKeyNMOKGUJAASZGKP-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.11
Rot. Bonds5

About 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide

3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide (PubChem CID 68502987) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
PubChem CID68502987
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESNC(=O)c1sccc1CCCN1CCOCC1
InChIInChI=1S/C12H18N2O2S/c13-12(15)11-10(3-9-17-11)2-1-4-14-5-7-16-8-6-14/h3,9H,1-2,4-8H2,(H2,13,15)
InChIKeyNMOKGUJAASZGKP-UHFFFAOYSA-N
XLogP1.11
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-carbamoylphenyl)-2-[[3-(3-morpholin-4-ylpropyl)thiophene-2-carbonyl]amino]-1,3-thiazole-4-carboxamide
CID 87441462
2-ethyl-2-[[3-(3-morpholin-4-ylpropyl)thiophene-2-carbonyl]amino]-3H-1,3-thiazole-4-carboxylic acid
CID 71111197
ethyl 5-[2-[[3-(3-morpholin-4-ylpropyl)thiophene-2-carbonyl]amino]-1,3-thiazol-4-yl]-1,2-oxazole-3-carboxylate
CID 87441731
3-(3-aminoprop-1-ynyl)-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 63801611
2-(4-morpholin-4-ylbutyl)phenol
CID 142043469
2-(2-morpholin-4-ylethyl)-1,3-thiazole-4-carboxamide
CID 141208836
3-(3-hydroxyprop-1-ynyl)-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 63796233
2-[3-[2-[[3-(3-morpholin-4-ylpropyl)thiophene-2-carbonyl]amino]-1,3-thiazol-4-yl]phenoxy]acetic acid
CID 87440950
2,3-diamino-4-(2-morpholin-4-ylethyl)benzamide
CID 18937435
4-[2-(3-morpholin-4-ylpropyl)phenyl]-1-phenylbutan-1-one
CID 54071748
4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299
1-[5-(3-morpholin-4-ylpropyl)furan-2-yl]ethanone
CID 162740835

Frequently Asked Questions

What is the IUPAC name of 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The IUPAC name of 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide (CID 68502987) is 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The canonical SMILES for 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide is NC(=O)c1sccc1CCCN1CCOCC1.
What is the InChIKey of 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The InChIKey is NMOKGUJAASZGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c13-12(15)11-10(3-9-17-11)2-1-4-14-5-7-16-8-6-14/h3,9H,1-2,4-8H2,(H2,13,15).
What are the key properties of 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide?
3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 68502987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).