N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide

C10H16N2OS — CID 119382828

IUPACN-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide
SMILESCC(C)c1ccsc1C(=O)NCCN
InChIInChI=1S/C10H16N2OS/c1-7(2)8-3-6-14-9(8)10(13)12-5-4-11/h3,6-7H,4-5,11H2,1-2H3,(H,12,13)
InChIKeyJIHPLNDNFWSPPK-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.56
Rot. Bonds4

About N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide

N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide (PubChem CID 119382828) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide
PubChem CID119382828
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide
SMILESCC(C)c1ccsc1C(=O)NCCN
InChIInChI=1S/C10H16N2OS/c1-7(2)8-3-6-14-9(8)10(13)12-5-4-11/h3,6-7H,4-5,11H2,1-2H3,(H,12,13)
InChIKeyJIHPLNDNFWSPPK-UHFFFAOYSA-N
XLogP1.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-hydroxyethoxy)propyl]-3-propan-2-ylthiophene-2-carboxamide
CID 110022323
N-[2-(5-methyltetrazol-2-yl)ethyl]-3-propan-2-ylthiophene-2-carboxamide
CID 71849693
N-(2-hydroxy-2-thiophen-3-ylethyl)-3-propan-2-ylthiophene-2-carboxamide
CID 111441647
N-[[1-(dimethylamino)cycloheptyl]methyl]-3-propan-2-ylthiophene-2-carboxamide
CID 71887575
N-(2-amino-2-oxoethyl)-N-methyl-3-propan-2-ylthiophene-2-carboxamide
CID 47366898
N-(2-aminoethyl)-3-cyclopropylthiophene-2-carboxamide;hydrochloride
CID 119383881
N-(3-aminopropyl)-3-methylsulfanylthiophene-2-carboxamide;hydrochloride
CID 119405175
N-(3-aminobutyl)-3-phenylthiophene-2-carboxamide
CID 119497469
3-amino-N-(5-methylhexyl)thiophene-2-carboxamide
CID 115324411
N-(2-acetamidoethyl)-3-aminothiophene-2-carboxamide
CID 61092677
N-[(2R)-2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]-3-propan-2-ylthiophene-2-carboxamide
CID 95776187
4-[(3-ethylthiophene-2-carbonyl)amino]-2-methylbutanoic acid
CID 80539115

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide?
The IUPAC name of N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide (CID 119382828) is N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide is CC(C)c1ccsc1C(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide?
The InChIKey is JIHPLNDNFWSPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7(2)8-3-6-14-9(8)10(13)12-5-4-11/h3,6-7H,4-5,11H2,1-2H3,(H,12,13).
What are the key properties of N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide?
N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide has a molecular weight of 212.32 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-3-propan-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 119382828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).