N-(3,3-dimethylbutyl)-2-hydroxyacetamide

C8H17NO2 — CID 115140033

IUPACN-(3,3-dimethylbutyl)-2-hydroxyacetamide
SMILESCC(C)(C)CCNC(=O)CO
InChIInChI=1S/C8H17NO2/c1-8(2,3)4-5-9-7(11)6-10/h10H,4-6H2,1-3H3,(H,9,11)
InChIKeyAXJAMQIHJWVMSH-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.53
Rot. Bonds3

About N-(3,3-dimethylbutyl)-2-hydroxyacetamide

N-(3,3-dimethylbutyl)-2-hydroxyacetamide (PubChem CID 115140033) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)-2-hydroxyacetamide
PubChem CID115140033
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC NameN-(3,3-dimethylbutyl)-2-hydroxyacetamide
SMILESCC(C)(C)CCNC(=O)CO
InChIInChI=1S/C8H17NO2/c1-8(2,3)4-5-9-7(11)6-10/h10H,4-6H2,1-3H3,(H,9,11)
InChIKeyAXJAMQIHJWVMSH-UHFFFAOYSA-N
XLogP0.53
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,3-dimethylbutyl)butanamide
CID 115580246
N-(3,3-dimethylbutyl)-4-(methylamino)butanamide
CID 115738133
3-cyano-N-(3,3-dimethylbutyl)propanamide
CID 115173922
N-(3,3-dimethylbutyl)-2-[1-(sulfanylmethyl)cyclopropyl]acetamide
CID 107035900
2-hydroxy-N-[3-[(2-hydroxyacetyl)amino]propyl]acetamide
CID 142043672
N-(3,3-dimethylbutyl)-2-(2-methylpropylsulfanyl)acetamide
CID 155110055
N-(3,3-dimethylbutyl)-11,11-dimethyl-4-oxododecanamide
CID 165080443
2-hydroxy-N-[7-[(2-hydroxyacetyl)amino]heptyl]acetamide
CID 119089107
N-(3-ethyl-3-hydroxypentyl)-4,4-dimethylpentanamide
CID 130469220
N-(5,5-dimethylhexyl)-4,4-dimethylpentanamide
CID 59197749
(E)-N-(3,3-dimethylbutyl)but-2-enamide
CID 115580737
(2S)-2-amino-N-(3,3-dimethylbutyl)-3,3-dimethylbutanamide
CID 103808439

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)-2-hydroxyacetamide?
The IUPAC name of N-(3,3-dimethylbutyl)-2-hydroxyacetamide (CID 115140033) is N-(3,3-dimethylbutyl)-2-hydroxyacetamide.
What is the SMILES notation for N-(3,3-dimethylbutyl)-2-hydroxyacetamide?
The canonical SMILES for N-(3,3-dimethylbutyl)-2-hydroxyacetamide is CC(C)(C)CCNC(=O)CO.
What is the InChIKey of N-(3,3-dimethylbutyl)-2-hydroxyacetamide?
The InChIKey is AXJAMQIHJWVMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-8(2,3)4-5-9-7(11)6-10/h10H,4-6H2,1-3H3,(H,9,11).
What are the key properties of N-(3,3-dimethylbutyl)-2-hydroxyacetamide?
N-(3,3-dimethylbutyl)-2-hydroxyacetamide has a molecular weight of 159.23 g/mol, XLogP of 0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)-2-hydroxyacetamide is sourced from PubChem (CID 115140033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).