N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide

C10H21NO3 — CID 114875437

IUPACN-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC(C)(O)CO
InChIInChI=1S/C10H21NO3/c1-4-8(2)5-9(13)11-6-10(3,14)7-12/h8,12,14H,4-7H2,1-3H3,(H,11,13)
InChIKeyZVEVDBQNOZFFRW-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.28
Rot. Bonds6

About N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide

N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide (PubChem CID 114875437) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
PubChem CID114875437
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC(C)(O)CO
InChIInChI=1S/C10H21NO3/c1-4-8(2)5-9(13)11-6-10(3,14)7-12/h8,12,14H,4-7H2,1-3H3,(H,11,13)
InChIKeyZVEVDBQNOZFFRW-UHFFFAOYSA-N
XLogP0.28
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
CID 103525819
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-3-methylpentanamide
CID 103522092
N-(2-ethyl-2-hydroxybutyl)-3-methylpentanamide
CID 114875415
5-[(2-hydroxy-2-methylbutyl)amino]-3-methyl-5-oxopentanoic acid
CID 65108474
N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide
CID 66168288
N-[2-(chloromethyl)-2-ethylbutyl]-3-methylpentanamide
CID 106254168
3-(4-aminophenyl)-N-(2,3-dihydroxy-2-methylpropyl)butanamide
CID 104502779
N-(3-amino-3-hydroxyimino-2,2-dimethylpropyl)-3-methylpentanamide
CID 104982329
N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpentanamide
CID 114875408
(3R)-N-(3-hydroxypropyl)-3-methylpentanamide
CID 173107720
4-[(4-amino-3-methylbutanoyl)amino]-3-hydroxy-3-methylbutanoic acid
CID 81079399
3-hydroxy-3-methyl-4-(3,5,5-trimethylhexanoylamino)butanoic acid
CID 66001344

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide (CID 114875437) is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide is CCC(C)CC(=O)NCC(C)(O)CO.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide?
The InChIKey is ZVEVDBQNOZFFRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-4-8(2)5-9(13)11-6-10(3,14)7-12/h8,12,14H,4-7H2,1-3H3,(H,11,13).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide?
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide has a molecular weight of 203.28 g/mol, XLogP of 0.28, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide is sourced from PubChem (CID 114875437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).