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

C10H14N2OS2 — CID 53383648

IUPAC2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide
SMILESCSCc1cc(C(=O)NC2CC2)c(N)s1
InChIInChI=1S/C10H14N2OS2/c1-14-5-7-4-8(9(11)15-7)10(13)12-6-2-3-6/h4,6H,2-3,5,11H2,1H3,(H,12,13)
InChIKeyNRHOFMYYZWAFRZ-UHFFFAOYSA-N
MW242.37 g/mol
LogP2.09
Rot. Bonds4

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

2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide (PubChem CID 53383648) has the molecular formula C10H14N2OS2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide
PubChem CID53383648
Molecular FormulaC10H14N2OS2
Molecular Weight242.37 g/mol
Exact Mass242.05
IUPAC Name2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide
SMILESCSCc1cc(C(=O)NC2CC2)c(N)s1
InChIInChI=1S/C10H14N2OS2/c1-14-5-7-4-8(9(11)15-7)10(13)12-6-2-3-6/h4,6H,2-3,5,11H2,1H3,(H,12,13)
InChIKeyNRHOFMYYZWAFRZ-UHFFFAOYSA-N
XLogP2.09
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-cyclopropyl-4-methylbenzamide;hydrochloride
CID 141105148
5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
CID 61466325
3-amino-N-cyclopropyl-5-(methylamino)thiophene-2-carboxamide
CID 103424255
2-amino-5-chloro-N-cyclopropyl-3-methylbenzamide
CID 121222069
2-amino-3-bromo-N-cyclopropyl-5-methylbenzamide
CID 170699654
3-amino-N-cyclopropyl-5-(2-methylsulfonylethylamino)thiophene-2-carboxamide
CID 103432236
5-amino-N-cyclopropyl-2-(propylamino)benzamide
CID 100638190
5-amino-2,4-dimethyl-N-(4-methylcyclohexyl)benzamide
CID 102704816
5-amino-N-(4-hydroxycyclohexyl)-2,4-dimethylbenzamide
CID 102704817
N-(4-aminocyclohexyl)-2,5-dichlorothiophene-3-carboxamide;hydrochloride
CID 119476389
2-amino-N-cyclopropyl-5-fluorobenzamide
CID 22493342
3-amino-N-cyclopropyl-5-(3-methylbut-2-enylamino)thiophene-2-carboxamide
CID 106199168

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide?
The IUPAC name of 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide (CID 53383648) is 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide?
The canonical SMILES for 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide is CSCc1cc(C(=O)NC2CC2)c(N)s1.
What is the InChIKey of 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide?
The InChIKey is NRHOFMYYZWAFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS2/c1-14-5-7-4-8(9(11)15-7)10(13)12-6-2-3-6/h4,6H,2-3,5,11H2,1H3,(H,12,13).
What are the key properties of 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide?
2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide has a molecular weight of 242.37 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-5-(methylsulfanylmethyl)thiophene-3-carboxamide is sourced from PubChem (CID 53383648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).