2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide

C16H18N2OS — CID 79983660

IUPAC2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide
SMILESNC(=O)C(NCc1cccs1)c1ccc(C2CC2)cc1
InChIInChI=1S/C16H18N2OS/c17-16(19)15(18-10-14-2-1-9-20-14)13-7-5-12(6-8-13)11-3-4-11/h1-2,5-9,11,15,18H,3-4,10H2,(H2,17,19)
InChIKeyFWHCUACRZILOSR-UHFFFAOYSA-N
MW286.40 g/mol
LogP2.94
Rot. Bonds6

About 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide

2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide (PubChem CID 79983660) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide
PubChem CID79983660
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC Name2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide
SMILESNC(=O)C(NCc1cccs1)c1ccc(C2CC2)cc1
InChIInChI=1S/C16H18N2OS/c17-16(19)15(18-10-14-2-1-9-20-14)13-7-5-12(6-8-13)11-3-4-11/h1-2,5-9,11,15,18H,3-4,10H2,(H2,17,19)
InChIKeyFWHCUACRZILOSR-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 54891569
2-(3,4-dihydroxyphenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 54890942
2-(cyclopropylmethylamino)-2-(4-cyclopropylphenyl)acetamide
CID 79983972
2-(4-bromo-3-methylphenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 66480373
2-(3-chloro-5-fluorophenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 114453595
methyl 2-(2-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetate
CID 79972889
2-(benzylamino)-2-(4-cyclopropylphenyl)acetic acid
CID 79972990
(2S)-2-(thiophen-2-ylmethylamino)butanediamide
CID 151018990
2-(2-ethoxyphenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 60997221
2-thiophen-2-yl-2-(thiophen-2-ylmethylamino)acetic acid
CID 61347911
2-(3-methylimidazol-4-yl)-2-(thiophen-2-ylmethylamino)acetamide
CID 66117109
2-(5-bromo-2-fluorophenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 54891133

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide?
The IUPAC name of 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide (CID 79983660) is 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide?
The canonical SMILES for 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide is NC(=O)C(NCc1cccs1)c1ccc(C2CC2)cc1.
What is the InChIKey of 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide?
The InChIKey is FWHCUACRZILOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c17-16(19)15(18-10-14-2-1-9-20-14)13-7-5-12(6-8-13)11-3-4-11/h1-2,5-9,11,15,18H,3-4,10H2,(H2,17,19).
What are the key properties of 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide?
2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide has a molecular weight of 286.40 g/mol, XLogP of 2.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-2-(thiophen-2-ylmethylamino)acetamide is sourced from PubChem (CID 79983660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).