N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide

C13H25NO2 — CID 111463685

IUPACN-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide
SMILESCCC(C)C(C)(O)CNC(=O)C1CCCC1
InChIInChI=1S/C13H25NO2/c1-4-10(2)13(3,16)9-14-12(15)11-7-5-6-8-11/h10-11,16H,4-9H2,1-3H3,(H,14,15)
InChIKeyPYKYTKXJGBCYAR-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.09
Rot. Bonds5

About N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide

N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide (PubChem CID 111463685) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide
PubChem CID111463685
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide
SMILESCCC(C)C(C)(O)CNC(=O)C1CCCC1
InChIInChI=1S/C13H25NO2/c1-4-10(2)13(3,16)9-14-12(15)11-7-5-6-8-11/h10-11,16H,4-9H2,1-3H3,(H,14,15)
InChIKeyPYKYTKXJGBCYAR-UHFFFAOYSA-N
XLogP2.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[(2-hydroxy-2,3-dimethylpentyl)amino]-3-oxopropyl]cyclohexanecarboxamide
CID 111477872
(3S)-N-[(2S,3S)-2-hydroxy-2,3-dimethylpentyl]oxane-3-carboxamide
CID 129428756
N-[4-[(2-hydroxy-2,3-dimethylpentyl)amino]-4-oxobutan-2-yl]cyclohexanecarboxamide
CID 111478031
N-(2-hydroxy-2,3-dimethylpentyl)thiolane-2-carboxamide
CID 111477877
N-(2-hydroxy-2-methylpropyl)cyclohexanecarboxamide
CID 65109688
N-(2-hydroxy-2,3-dimethylpentyl)-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide
CID 111463611
3-(cyclopentanecarbonylamino)-2-hydroxy-2-methylpropanoic acid
CID 66173795
N-(2-cyclopropyl-2-hydroxypropyl)cyclohexanecarboxamide
CID 90499250
N-[3-(cyclopentanecarbonylamino)-2,2-bis[(cyclopentanecarbonylamino)methyl]propyl]cyclopentanecarboxamide
CID 153313338
N-(2-hydroxy-2,3-dimethylpentyl)-2-(oxan-4-yl)propanamide
CID 109476485
N-(2-methylpropyl)cyclooctanecarboxamide
CID 65022959
N-(2-cyclopropyl-2-hydroxypropyl)cyclobutanecarboxamide
CID 90499246

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide?
The IUPAC name of N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide (CID 111463685) is N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide?
The canonical SMILES for N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide is CCC(C)C(C)(O)CNC(=O)C1CCCC1.
What is the InChIKey of N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide?
The InChIKey is PYKYTKXJGBCYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-4-10(2)13(3,16)9-14-12(15)11-7-5-6-8-11/h10-11,16H,4-9H2,1-3H3,(H,14,15).
What are the key properties of N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide?
N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide has a molecular weight of 227.35 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2,3-dimethylpentyl)cyclopentanecarboxamide is sourced from PubChem (CID 111463685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).