2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide

C12H18N2O2S — CID 114229290

IUPAC2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide
SMILESCOC(C)(C)c1csc(N)c1C(=O)NC1CC1
InChIInChI=1S/C12H18N2O2S/c1-12(2,16-3)8-6-17-10(13)9(8)11(15)14-7-4-5-7/h6-7H,4-5,13H2,1-3H3,(H,14,15)
InChIKeyZCDABBLBETXYER-UHFFFAOYSA-N
MW254.35 g/mol
LogP2.10
Rot. Bonds4

About 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide

2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide (PubChem CID 114229290) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide
PubChem CID114229290
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC Name2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide
SMILESCOC(C)(C)c1csc(N)c1C(=O)NC1CC1
InChIInChI=1S/C12H18N2O2S/c1-12(2,16-3)8-6-17-10(13)9(8)11(15)14-7-4-5-7/h6-7H,4-5,13H2,1-3H3,(H,14,15)
InChIKeyZCDABBLBETXYER-UHFFFAOYSA-N
XLogP2.10
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-tert-butyl-N-cyclopentylthiophene-3-carboxamide
CID 82056766
2-amino-N-cyclopentyl-4-methylthiophene-3-carboxamide
CID 82056795
methyl 2-amino-4-cyclopentylthiophene-3-carboxylate
CID 62633873
2-amino-N-(1-tert-butylpiperidin-4-yl)-1,3-thiazole-4-carboxamide
CID 62788760
tert-butyl 3-(thiophene-2-carbonylamino)pyrrolidine-1-carboxylate
CID 71629640
methyl 4-(1-adamantyl)-2-aminothiophene-3-carboxylate
CID 29037449
2,6-dimethoxy-N-[4-(methylamino)cyclohexyl]benzamide
CID 43653176
4-bromo-N-cyclopropylthiophene-2-carboxamide
CID 110763428
4-amino-N-(4-methoxycyclohexyl)-1-methylpyrazole-3-carboxamide
CID 59733437
2-N-(4-aminocyclohexyl)thiophene-2,4-dicarboxamide
CID 119477780
methyl 4-amino-5-(cyclopropylcarbamoyl)-2-(2-methylpropylamino)thiophene-3-carboxylate
CID 103423779
2-amino-N-cyclopropyl-4,4-dimethyl-5,6-dihydrocyclopenta[b]thiophene-3-carboxamide
CID 79864013

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide?
The IUPAC name of 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide (CID 114229290) is 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide?
The canonical SMILES for 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide is COC(C)(C)c1csc(N)c1C(=O)NC1CC1.
What is the InChIKey of 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide?
The InChIKey is ZCDABBLBETXYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-12(2,16-3)8-6-17-10(13)9(8)11(15)14-7-4-5-7/h6-7H,4-5,13H2,1-3H3,(H,14,15).
What are the key properties of 2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide?
2-amino-N-cyclopropyl-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide has a molecular weight of 254.35 g/mol, XLogP of 2.10, 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-4-(2-methoxypropan-2-yl)thiophene-3-carboxamide is sourced from PubChem (CID 114229290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).