4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide

C12H14N2O2S — CID 61140224

IUPAC4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NCCc2ccco2)cc1N
InChIInChI=1S/C12H14N2O2S/c1-8-10(13)7-11(17-8)12(15)14-5-4-9-3-2-6-16-9/h2-3,6-7H,4-5,13H2,1H3,(H,14,15)
InChIKeyKOOKYDNJWBLDJL-UHFFFAOYSA-N
MW250.32 g/mol
LogP2.20
Rot. Bonds4

About 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide

4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide (PubChem CID 61140224) has the molecular formula C12H14N2O2S and a molecular weight of 250.32 g/mol. Its IUPAC name is 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide
PubChem CID61140224
Molecular FormulaC12H14N2O2S
Molecular Weight250.32 g/mol
Exact Mass250.08
IUPAC Name4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NCCc2ccco2)cc1N
InChIInChI=1S/C12H14N2O2S/c1-8-10(13)7-11(17-8)12(15)14-5-4-9-3-2-6-16-9/h2-3,6-7H,4-5,13H2,1H3,(H,14,15)
InChIKeyKOOKYDNJWBLDJL-UHFFFAOYSA-N
XLogP2.20
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 61140792
4-amino-N-[2-(2-fluorophenyl)ethyl]-5-methylthiophene-2-carboxamide
CID 61093123
4-amino-N-[2-(4-chlorophenyl)ethyl]-5-methylthiophene-2-carboxamide
CID 61117048
4-amino-N-[2-(3-chlorophenyl)ethyl]-5-methylthiophene-2-carboxamide
CID 61113254
N-[2-(furan-2-yl)ethyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
CID 24542540
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
4-amino-5-methyl-N-(3-methylbutyl)thiophene-2-carboxamide
CID 61090653
3-amino-5-bromo-N-[2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 107872467
N-[2-(furan-2-yl)ethyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 47015184
5-amino-2-fluoro-N-[2-(furan-2-yl)ethyl]-3-methylbenzamide
CID 103296184
4-amino-N-[2-(furan-2-yl)ethyl]-2-(methylamino)-1,3-thiazole-5-carboxamide
CID 116663748
3-amino-N-[2-(furan-2-yl)ethyl]-2-hydroxybenzamide
CID 113386431

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide (CID 61140224) is 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide is Cc1sc(C(=O)NCCc2ccco2)cc1N.
What is the InChIKey of 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide?
The InChIKey is KOOKYDNJWBLDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2S/c1-8-10(13)7-11(17-8)12(15)14-5-4-9-3-2-6-16-9/h2-3,6-7H,4-5,13H2,1H3,(H,14,15).
What are the key properties of 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide?
4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide has a molecular weight of 250.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(furan-2-yl)ethyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 61140224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).