(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide

C13H17N3OS — CID 92582168

IUPAC(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N[C@@H](C)Cc1cccs1)n1ccnc1
InChIInChI=1S/C13H17N3OS/c1-10(8-12-4-3-7-18-12)15-13(17)11(2)16-6-5-14-9-16/h3-7,9-11H,8H2,1-2H3,(H,15,17)/t10-,11+/m0/s1
InChIKeyGDVOSUXTPHTZJS-WDEREUQCSA-N
MW263.37 g/mol
LogP2.25
Rot. Bonds5

About (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide

(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide (PubChem CID 92582168) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide
PubChem CID92582168
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide
SMILESC[C@H](C(=O)N[C@@H](C)Cc1cccs1)n1ccnc1
InChIInChI=1S/C13H17N3OS/c1-10(8-12-4-3-7-18-12)15-13(17)11(2)16-6-5-14-9-16/h3-7,9-11H,8H2,1-2H3,(H,15,17)/t10-,11+/m0/s1
InChIKeyGDVOSUXTPHTZJS-WDEREUQCSA-N
XLogP2.25
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119722730
3-bromo-N-(1-thiophen-2-ylpropan-2-yl)propanamide
CID 82110960
(2S)-2-amino-3-methyl-N-(1-thiophen-2-ylpropan-2-yl)pentanamide
CID 61174235
N-(4-pyridin-4-yloxyphenyl)-N'-[(2R)-1-thiophen-2-ylpropan-2-yl]oxamide
CID 99619776
1-(thiophen-2-ylmethyl)-3-(1-thiophen-2-ylpropan-2-yl)urea
CID 45497246
2-(propan-2-ylamino)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
CID 60842186
5-amino-1-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazole-4-carboxamide
CID 115330850
N-propan-2-yl-2-(1-thiophen-2-ylpropan-2-ylamino)propanamide
CID 63291724
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
3-amino-2-phenyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119722711
3-amino-2-methyl-3-phenyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119722719
N-[(2S)-1-hydroxypropan-2-yl]-2-(4-methylphenyl)-3-thiophen-2-ylpropanamide
CID 110306927

Frequently Asked Questions

What is the IUPAC name of (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide?
The IUPAC name of (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide (CID 92582168) is (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide.
What is the SMILES notation for (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide?
The canonical SMILES for (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide is C[C@H](C(=O)N[C@@H](C)Cc1cccs1)n1ccnc1.
What is the InChIKey of (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide?
The InChIKey is GDVOSUXTPHTZJS-WDEREUQCSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-10(8-12-4-3-7-18-12)15-13(17)11(2)16-6-5-14-9-16/h3-7,9-11H,8H2,1-2H3,(H,15,17)/t10-,11+/m0/s1.
What are the key properties of (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide?
(2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide has a molecular weight of 263.37 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-imidazol-1-yl-N-[(2S)-1-thiophen-2-ylpropan-2-yl]propanamide is sourced from PubChem (CID 92582168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).