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

C8H17NO3 — CID 66168288

IUPACN-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide
SMILESCC(C)C(=O)NCC(C)(O)CO
InChIInChI=1S/C8H17NO3/c1-6(2)7(11)9-4-8(3,12)5-10/h6,10,12H,4-5H2,1-3H3,(H,9,11)
InChIKeyTXQHOKFIFUGFQD-UHFFFAOYSA-N
MW175.23 g/mol
LogP-0.50
Rot. Bonds4

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

N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide (PubChem CID 66168288) has the molecular formula C8H17NO3 and a molecular weight of 175.23 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide
PubChem CID66168288
Molecular FormulaC8H17NO3
Molecular Weight175.23 g/mol
Exact Mass175.12
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide
SMILESCC(C)C(=O)NCC(C)(O)CO
InChIInChI=1S/C8H17NO3/c1-6(2)7(11)9-4-8(3,12)5-10/h6,10,12H,4-5H2,1-3H3,(H,9,11)
InChIKeyTXQHOKFIFUGFQD-UHFFFAOYSA-N
XLogP-0.50
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpropanamide
CID 66180454
(2R)-2-amino-N-(2,3-dihydroxy-2-methylpropyl)-3,3-dimethylbutanamide
CID 103930127
ethane;N-(2-hydroxy-2-methylpropyl)-2-methylpropanamide
CID 145182364
N-(2,3-dihydroxy-2-methylpropyl)-3-(ethylamino)-2-methylpropanamide
CID 66185352
2-(azetidin-3-yl)-N-(2,3-dihydroxy-2-methylpropyl)propanamide
CID 116678297
propan-2-yl N-(2,3-dihydroxy-2-methylpropyl)carbamate
CID 66170109
N-(2,2-difluoropropyl)-2-methylpropanamide
CID 130436254
N-(2,3-dihydroxy-2-methylpropyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 66170276
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
CID 114875437
N-(2,3-dihydroxy-2-methylpropyl)-2-phenoxypropanamide
CID 66169775
2-(4-bromophenoxy)-N-(2,3-dihydroxy-2-methylpropyl)propanamide
CID 66170661
N-(2-hydroxy-2-propylpentyl)-2-methylpropanamide
CID 111444753

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide (CID 66168288) is N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide is CC(C)C(=O)NCC(C)(O)CO.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide?
The InChIKey is TXQHOKFIFUGFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO3/c1-6(2)7(11)9-4-8(3,12)5-10/h6,10,12H,4-5H2,1-3H3,(H,9,11).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide?
N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide has a molecular weight of 175.23 g/mol, XLogP of -0.50, 4 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)-2-methylpropanamide is sourced from PubChem (CID 66168288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).