3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide

C13H25NO2 — CID 65114785

IUPAC3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide
SMILESCCC(C)(O)CNC(=O)CCC1CCCC1
InChIInChI=1S/C13H25NO2/c1-3-13(2,16)10-14-12(15)9-8-11-6-4-5-7-11/h11,16H,3-10H2,1-2H3,(H,14,15)
InChIKeyBPZZFDKRLANRGR-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.23
Rot. Bonds6

About 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide

3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide (PubChem CID 65114785) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide
PubChem CID65114785
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide
SMILESCCC(C)(O)CNC(=O)CCC1CCCC1
InChIInChI=1S/C13H25NO2/c1-3-13(2,16)10-14-12(15)9-8-11-6-4-5-7-11/h11,16H,3-10H2,1-2H3,(H,14,15)
InChIKeyBPZZFDKRLANRGR-UHFFFAOYSA-N
XLogP2.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-methylpropyl)-3-cyclopentylpropanamide
CID 81425234
N-(2-hydroxy-2-methylbutyl)-3-methylsulfanylpropanamide
CID 65114452
3-[[2-(3-cyclopentylpropanoylamino)acetyl]amino]-2,2-dimethylpropanoic acid
CID 119250220
4-cyclohexyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]butanamide
CID 103839791
3-cyclopentyl-N-(2,2-difluoro-3-hydroxypropyl)propanamide
CID 104858128
3-(tert-butylamino)-N-(2-hydroxy-2-methylbutyl)propanamide
CID 65106616
3-cyclopentyl-N-prop-2-ynylpropanamide
CID 60646217
3-cyclopentyl-N-(2-methylpropyl)propanamide
CID 918369
3-cyclopentyl-N-(3-hydroxy-2,3-dimethylbutan-2-yl)propanamide
CID 103895541
3-cyclopentyl-N-[2-(propylamino)ethyl]propanamide
CID 62658625
N-(2-amino-2-ethylbutyl)-4-cyclopentylbutanamide;hydrochloride
CID 119644018
N-(2-hydroxy-2-methylbutyl)thiane-2-carboxamide
CID 80595877

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide (CID 65114785) is 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide is CCC(C)(O)CNC(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide?
The InChIKey is BPZZFDKRLANRGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-3-13(2,16)10-14-12(15)9-8-11-6-4-5-7-11/h11,16H,3-10H2,1-2H3,(H,14,15).
What are the key properties of 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide?
3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide has a molecular weight of 227.35 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(2-hydroxy-2-methylbutyl)propanamide is sourced from PubChem (CID 65114785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).