N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide

C10H19NO2 — CID 115701552

IUPACN-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide
SMILESCC(C)C(O)CNC(=O)C1CC1C
InChIInChI=1S/C10H19NO2/c1-6(2)9(12)5-11-10(13)8-4-7(8)3/h6-9,12H,4-5H2,1-3H3,(H,11,13)
InChIKeyRJWAZTBEUPICPB-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.78
Rot. Bonds4

About N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide

N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 115701552) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide
PubChem CID115701552
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide
SMILESCC(C)C(O)CNC(=O)C1CC1C
InChIInChI=1S/C10H19NO2/c1-6(2)9(12)5-11-10(13)8-4-7(8)3/h6-9,12H,4-5H2,1-3H3,(H,11,13)
InChIKeyRJWAZTBEUPICPB-UHFFFAOYSA-N
XLogP0.78
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2-hydroxypropyl]-2-methylcyclopropane-1-carboxamide
CID 83032173
4-ethyl-2-[(2-hydroxy-3-methylbutyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114512122
N-(2-hydroxy-3-methylbutyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 103838536
N-(2-hydroxy-3-methylbutyl)cyclopent-3-ene-1-carboxamide
CID 115701623
(3S)-5-methyl-3-[[(2-methylcyclopropanecarbonyl)amino]methyl]hexanoic acid
CID 65492659
5-amino-N-(2,3-dimethylbutyl)-2,4-dimethylcyclohexane-1-carboxamide
CID 102706782
N-(2-hydroxy-3-methylbutyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 109478559
(2-hydroxy-3-methylbutyl)carbamic acid
CID 135330394
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-methylcyclopropane-1-carboxamide
CID 110885456
cis-(1R,2S)-2-methyl-N-propylcyclopropane-1-carboxamide
CID 95357811
4-tert-butyl-N-(2-hydroxy-3-methylbutyl)cyclohexane-1-carboxamide
CID 115744551
N-[2-(2-bromoethyl)pentyl]-2-methylcyclopropane-1-carboxamide
CID 106117840

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide (CID 115701552) is N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide is CC(C)C(O)CNC(=O)C1CC1C.
What is the InChIKey of N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is RJWAZTBEUPICPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-6(2)9(12)5-11-10(13)8-4-7(8)3/h6-9,12H,4-5H2,1-3H3,(H,11,13).
What are the key properties of N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide?
N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methylbutyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 115701552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).