2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide

C8H13NO2 — CID 174392631

IUPAC2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide
SMILESC[C@@H](C=O)NC(=O)CC1CC1
InChIInChI=1S/C8H13NO2/c1-6(5-10)9-8(11)4-7-2-3-7/h5-7H,2-4H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyYYCGHKJXARAEOL-LURJTMIESA-N
MW155.20 g/mol
LogP0.49
Rot. Bonds4

About 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide

2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide (PubChem CID 174392631) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide
PubChem CID174392631
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide
SMILESC[C@@H](C=O)NC(=O)CC1CC1
InChIInChI=1S/C8H13NO2/c1-6(5-10)9-8(11)4-7-2-3-7/h5-7H,2-4H2,1H3,(H,9,11)/t6-/m0/s1
InChIKeyYYCGHKJXARAEOL-LURJTMIESA-N
XLogP0.49
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
2-cyclopropyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]acetamide
CID 79252136
(2S)-2-[(2-cyclopropylacetyl)amino]-4-methylpentanoic acid
CID 61136657
2-(4-aminocyclohexyl)-N-(3,3-dimethylbutan-2-yl)acetamide
CID 104830066
2-(azetidin-3-yl)-N-but-3-en-2-ylacetamide
CID 115739602
N-propan-2-yl-2-(thian-4-yl)acetamide
CID 80708318
N-(1-aminobutan-2-yl)-2-cyclopropylacetamide
CID 63755358
2-[(2-cyclopropylacetyl)amino]-3,3-dimethylbutanoic acid
CID 43467501
(2S)-2-[(2-cyclohexylacetyl)amino]propanoic acid
CID 51604978
methyl (2S)-2-[(2-cyclopentylacetyl)amino]propanoate
CID 54564390
2-cyclobutyl-N-(1-hydroxy-3-methylbutan-2-yl)acetamide
CID 103164734
N-[(2S)-1-aminopropan-2-yl]-2-cycloheptylacetamide
CID 120507495

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide (CID 174392631) is 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide is C[C@@H](C=O)NC(=O)CC1CC1.
What is the InChIKey of 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide?
The InChIKey is YYCGHKJXARAEOL-LURJTMIESA-N. The full InChI is InChI=1S/C8H13NO2/c1-6(5-10)9-8(11)4-7-2-3-7/h5-7H,2-4H2,1H3,(H,9,11)/t6-/m0/s1.
What are the key properties of 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide?
2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide has a molecular weight of 155.20 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(2S)-1-oxopropan-2-yl]acetamide is sourced from PubChem (CID 174392631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).