N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide

C10H19NO2 — CID 61246468

IUPACN-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide
SMILESCC(C)CC(CO)NC(=O)C1CC1
InChIInChI=1S/C10H19NO2/c1-7(2)5-9(6-12)11-10(13)8-3-4-8/h7-9,12H,3-6H2,1-2H3,(H,11,13)
InChIKeyLTKFRWDDOCICIO-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.92
Rot. Bonds5

About N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide

N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide (PubChem CID 61246468) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide
PubChem CID61246468
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide
SMILESCC(C)CC(CO)NC(=O)C1CC1
InChIInChI=1S/C10H19NO2/c1-7(2)5-9(6-12)11-10(13)8-3-4-8/h7-9,12H,3-6H2,1-2H3,(H,11,13)
InChIKeyLTKFRWDDOCICIO-UHFFFAOYSA-N
XLogP0.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-hydroxy-4-methylpentan-2-yl)cycloheptanecarboxamide
CID 62588514
N-(1-hydroxy-4-methylpentan-2-yl)piperidine-4-carboxamide
CID 61246607
N-(1-hydroxy-4-methylpentan-2-yl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 61246188
N-(4-methylpentan-2-yl)cyclopropanecarboxamide
CID 64592829
N-(1-amino-4-methylpentan-2-yl)cyclohexanecarboxamide;hydrochloride
CID 119260890
N-(1-amino-4-methylpentan-2-yl)cycloheptanecarboxamide
CID 63755259
N-(1-chloro-4-methylpentan-2-yl)cyclooctanecarboxamide
CID 113272544
N-(1-hydroxy-4-methylpentan-2-yl)pyrrolidine-2-carboxamide
CID 61246606
N-[(2R)-1-(dimethylamino)-4-methylpentan-2-yl]cyclobutanecarboxamide
CID 95159057
N-[(2S)-1-(dimethylamino)-4-methylpentan-2-yl]cyclobutanecarboxamide
CID 95159056
4-(4-methylpentan-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 120674506
N-[(2S)-1-hydroxybutan-2-yl]cyclohexanecarboxamide
CID 854995

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide (CID 61246468) is N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide is CC(C)CC(CO)NC(=O)C1CC1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide?
The InChIKey is LTKFRWDDOCICIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-7(2)5-9(6-12)11-10(13)8-3-4-8/h7-9,12H,3-6H2,1-2H3,(H,11,13).
What are the key properties of N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide?
N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide has a molecular weight of 185.27 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 61246468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).