N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide

C10H17NO2 — CID 76825713

IUPACN-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide
SMILESCC(=O)NC(C(=O)C(C)C)C1CC1
InChIInChI=1S/C10H17NO2/c1-6(2)10(13)9(8-4-5-8)11-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,11,12)
InChIKeyXEKRXWGJDMARHW-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.13
Rot. Bonds4

About N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide

N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide (PubChem CID 76825713) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide.

Molecular Properties

Compound NameN-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide
PubChem CID76825713
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide
SMILESCC(=O)NC(C(=O)C(C)C)C1CC1
InChIInChI=1S/C10H17NO2/c1-6(2)10(13)9(8-4-5-8)11-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,11,12)
InChIKeyXEKRXWGJDMARHW-UHFFFAOYSA-N
XLogP1.13
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-acetamido-2-cyclopropylacetate
CID 121215489
(2R)-2-acetamido-2-cyclobutylacetic acid
CID 91654951
1-cyclopentyl-3-methyl-1-(propan-2-ylamino)butan-2-one
CID 58862415
N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)acetamide
CID 77038392
methyl N-[(1R)-3-methyl-1-(oxan-4-yl)-2-oxobutyl]carbamate
CID 59470809
(2S)-2-acetamido-2-cyclopentylacetamide
CID 177134286
(2S)-2-acetamido-N-cyclooctyl-2-cyclopentylacetamide
CID 94491136
N-(1-cyclobutylethyl)acetamide
CID 115769098
N-[(1S)-1-cyclopentylethyl]acetamide
CID 81388909
methyl (2S)-2-[(2-acetamido-2-cyclopentylacetyl)amino]propanoate
CID 87040294
(2R)-2-acetamido-2-[4-(diaminomethylideneamino)cyclohexyl]acetic acid
CID 22840786
2-acetamido-2-cyclopentyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 134026215

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide?
The IUPAC name of N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide (CID 76825713) is N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide.
What is the SMILES notation for N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide?
The canonical SMILES for N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide is CC(=O)NC(C(=O)C(C)C)C1CC1.
What is the InChIKey of N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide?
The InChIKey is XEKRXWGJDMARHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-6(2)10(13)9(8-4-5-8)11-7(3)12/h6,8-9H,4-5H2,1-3H3,(H,11,12).
What are the key properties of N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide?
N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide has a molecular weight of 183.25 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-3-methyl-2-oxobutyl)acetamide is sourced from PubChem (CID 76825713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).