N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide

C10H12N2O2 — CID 12859609

IUPACN-[(2S)-1-amino-1-oxopropan-2-yl]benzamide
SMILESC[C@H](NC(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C10H12N2O2/c1-7(9(11)13)12-10(14)8-5-3-2-4-6-8/h2-7H,1H3,(H2,11,13)(H,12,14)/t7-/m0/s1
InChIKeyZWDNWUISPPRMSS-ZETCQYMHSA-N
MW192.22 g/mol
LogP0.29
Rot. Bonds3

About N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide

N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide (PubChem CID 12859609) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[(2S)-1-amino-1-oxopropan-2-yl]benzamide
PubChem CID12859609
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC NameN-[(2S)-1-amino-1-oxopropan-2-yl]benzamide
SMILESC[C@H](NC(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C10H12N2O2/c1-7(9(11)13)12-10(14)8-5-3-2-4-6-8/h2-7H,1H3,(H2,11,13)(H,12,14)/t7-/m0/s1
InChIKeyZWDNWUISPPRMSS-ZETCQYMHSA-N
XLogP0.29
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl (2S)-2-benzamidopropanoate
CID 6364617
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CID 43545835
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]benzamide
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N-[(2R)-1-amino-1-oxopropan-2-yl]-3-hydroxybenzamide
CID 171390389
N-(1-amino-1-oxopropan-2-yl)-3-chlorobenzamide
CID 54104367
N-[(2S)-1-amino-1-oxopropan-2-yl]-3-iodobenzamide
CID 130166251
N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]benzamide
CID 42909871
ethane;N-(4-methyl-3-oxopentan-2-yl)benzamide
CID 168983006
N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 68732786
N-(1-amino-1-oxopropan-2-yl)-4-ethylbenzamide
CID 134045614
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CID 134045728

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide?
The IUPAC name of N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide (CID 12859609) is N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide?
The canonical SMILES for N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide is C[C@H](NC(=O)c1ccccc1)C(N)=O.
What is the InChIKey of N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide?
The InChIKey is ZWDNWUISPPRMSS-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-7(9(11)13)12-10(14)8-5-3-2-4-6-8/h2-7H,1H3,(H2,11,13)(H,12,14)/t7-/m0/s1.
What are the key properties of N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide?
N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide has a molecular weight of 192.22 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 12859609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).