4-(2-hydroxyethoxy)-4-methylpentanamide

C8H17NO3 — CID 167307614

IUPAC4-(2-hydroxyethoxy)-4-methylpentanamide
SMILESCC(C)(CCC(N)=O)OCCO
InChIInChI=1S/C8H17NO3/c1-8(2,12-6-5-10)4-3-7(9)11/h10H,3-6H2,1-2H3,(H2,9,11)
InChIKeyLSCSIDQCNQETIM-UHFFFAOYSA-N
MW175.23 g/mol
LogP0.04
Rot. Bonds6

About 4-(2-hydroxyethoxy)-4-methylpentanamide

4-(2-hydroxyethoxy)-4-methylpentanamide (PubChem CID 167307614) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-(2-hydroxyethoxy)-4-methylpentanamide.

Molecular Properties

Compound Name4-(2-hydroxyethoxy)-4-methylpentanamide
PubChem CID167307614
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC Name4-(2-hydroxyethoxy)-4-methylpentanamide
SMILESCC(C)(CCC(N)=O)OCCO
InChIInChI=1S/C8H17NO3/c1-8(2,12-6-5-10)4-3-7(9)11/h10H,3-6H2,1-2H3,(H2,9,11)
InChIKeyLSCSIDQCNQETIM-UHFFFAOYSA-N
XLogP0.04
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,3-dimethylpentoxy)-4-methylpentanamide;ethane
CID 156884875
2-(2-hydroxyethoxy)-2-methylpropanamide
CID 173016422
3-[3-(2-hydroxyethoxy)-3-methylbutoxy]-3-methylbutanoic acid
CID 166655528
4-(2,4,4-trimethylpentan-2-yloxy)butanamide
CID 138571120
4,4-dimethylpentanamide;hydrochloride
CID 141202343
4-[3-[(4-hydroxy-2-methylbutan-2-yl)amino]-3-methylbutoxy]-4-methylpentanoic acid
CID 129177449
4-(3-methyl-3-propoxybutoxy)pentanamide
CID 164574576
2-methylbutan-2-yl 4-(3-amino-3-methylbutoxy)-4-methylpentanoate
CID 167070130
5-amino-4-(2-hydroxyethoxy)-4-methylpentanoic acid
CID 165493841
ethane;4-(3-methyl-3-propoxybutoxy)pentanamide
CID 164574575
4-(3-amino-3-methylbutoxy)-N-(4-hydroxy-2-methylbutan-2-yl)-4-methylpentanamide;2,2-dimethylpropane
CID 155698441
[3-[2-[3-[2-[3-[2-[3-(2-hydroxyethoxy)-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutyl] methoxymethoxymethoxymethoxymethyl carbonate
CID 130210461

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethoxy)-4-methylpentanamide?
The IUPAC name of 4-(2-hydroxyethoxy)-4-methylpentanamide (CID 167307614) is 4-(2-hydroxyethoxy)-4-methylpentanamide.
What is the SMILES notation for 4-(2-hydroxyethoxy)-4-methylpentanamide?
The canonical SMILES for 4-(2-hydroxyethoxy)-4-methylpentanamide is CC(C)(CCC(N)=O)OCCO.
What is the InChIKey of 4-(2-hydroxyethoxy)-4-methylpentanamide?
The InChIKey is LSCSIDQCNQETIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c1-8(2,12-6-5-10)4-3-7(9)11/h10H,3-6H2,1-2H3,(H2,9,11).
What are the key properties of 4-(2-hydroxyethoxy)-4-methylpentanamide?
4-(2-hydroxyethoxy)-4-methylpentanamide has a molecular weight of 175.23 g/mol, XLogP of 0.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethoxy)-4-methylpentanamide is sourced from PubChem (CID 167307614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).