3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide

C9H13N3OS — CID 103424255

IUPAC3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide
SMILESCNc1cc(N)c(C(=O)NC2CC2)s1
InChIInChI=1S/C9H13N3OS/c1-11-7-4-6(10)8(14-7)9(13)12-5-2-3-5/h4-5,11H,2-3,10H2,1H3,(H,12,13)
InChIKeyMZMWCKYKVHQZPT-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.26
Rot. Bonds3

About 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide

3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide (PubChem CID 103424255) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide
PubChem CID103424255
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC Name3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide
SMILESCNc1cc(N)c(C(=O)NC2CC2)s1
InChIInChI=1S/C9H13N3OS/c1-11-7-4-6(10)8(14-7)9(13)12-5-2-3-5/h4-5,11H,2-3,10H2,1H3,(H,12,13)
InChIKeyMZMWCKYKVHQZPT-UHFFFAOYSA-N
XLogP1.26
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-cyclopropyl-5-(2-methylsulfonylethylamino)thiophene-2-carboxamide
CID 103432236
3-amino-N-cyclopropyl-5-[(1-methylpiperidin-4-yl)amino]thiophene-2-carboxamide
CID 103427442
3-amino-N-cyclopropyl-5-(3-methylbut-2-enylamino)thiophene-2-carboxamide
CID 106199168
3-amino-N-cyclopropyl-5-(2,2,3,3-tetrafluoropropylamino)thiophene-2-carboxamide
CID 106296562
1-[3-amino-5-(methylamino)thiophen-2-yl]-2-methylpropan-1-one
CID 103424271
3-amino-N-cyclopropyl-5-(4-propan-2-yloxybutylamino)thiophene-2-carboxamide
CID 106017402
3-amino-N-cyclopropyl-5-pyrrolidin-1-ylthiophene-2-carboxamide
CID 103418986
3-amino-N-cyclopropyl-5-(4-methylazepan-1-yl)thiophene-2-carboxamide
CID 103422093
1-[3-amino-5-[(4-methylcyclohexyl)amino]thiophen-2-yl]ethanone
CID 103426543
5-amino-N-cyclopropyl-3-methyl-4-(2-methylpropanoyl)thiophene-2-carboxamide
CID 65355341
3-amino-N-cyclopropyl-4-methoxy-5-(methylamino)thiophene-2-carboxamide
CID 103424225
methyl 4-amino-5-(cyclopropylcarbamoyl)-2-(methylamino)thiophene-3-carboxylate
CID 103424181

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide (CID 103424255) is 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide is CNc1cc(N)c(C(=O)NC2CC2)s1.
What is the InChIKey of 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide?
The InChIKey is MZMWCKYKVHQZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c1-11-7-4-6(10)8(14-7)9(13)12-5-2-3-5/h4-5,11H,2-3,10H2,1H3,(H,12,13).
What are the key properties of 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide?
3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.26, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide is sourced from PubChem (CID 103424255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).