2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide

C11H21NO2 — CID 103945988

IUPAC2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)CC1CC1
InChIInChI=1S/C11H21NO2/c1-3-11(2,6-7-13)12-10(14)8-9-4-5-9/h9,13H,3-8H2,1-2H3,(H,12,14)
InChIKeyJVRQDYMFUJWEOJ-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.45
Rot. Bonds6

About 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide

2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide (PubChem CID 103945988) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
PubChem CID103945988
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
SMILESCCC(C)(CCO)NC(=O)CC1CC1
InChIInChI=1S/C11H21NO2/c1-3-11(2,6-7-13)12-10(14)8-9-4-5-9/h9,13H,3-8H2,1-2H3,(H,12,14)
InChIKeyJVRQDYMFUJWEOJ-UHFFFAOYSA-N
XLogP1.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
CID 106176187
N-(1-chloro-3-methylpentan-3-yl)-2-cyclobutylacetamide
CID 106168566
N-(1-hydroxy-3-methylpentan-3-yl)propanamide
CID 103946136
N-(1-bromo-2-methylbutan-2-yl)-2-cycloheptylacetamide
CID 114459098
N-(1-bromo-2-methylbutan-2-yl)-2-cyclohexylacetamide
CID 114314529
N-(1-hydroxy-3-methylpentan-3-yl)-2-(propylamino)acetamide
CID 106176447
methyl (3S)-3-methyl-3-[(2-piperidin-4-ylacetyl)amino]pentanoate
CID 124597025
2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride
CID 119785992
2-cyano-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
CID 104920642
N-(1-hydroxy-3-methylpentan-3-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 103945589
N-(1-hydroxy-3-methylpentan-3-yl)-3,4,4-trimethylpentanamide
CID 103945842
1-(1-hydroxy-3-methylpentan-3-yl)-3-methylurea
CID 103819942

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The IUPAC name of 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide (CID 103945988) is 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide.
What is the SMILES notation for 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The canonical SMILES for 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide is CCC(C)(CCO)NC(=O)CC1CC1.
What is the InChIKey of 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
The InChIKey is JVRQDYMFUJWEOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-11(2,6-7-13)12-10(14)8-9-4-5-9/h9,13H,3-8H2,1-2H3,(H,12,14).
What are the key properties of 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide?
2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide has a molecular weight of 199.29 g/mol, XLogP of 1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide is sourced from PubChem (CID 103945988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).