N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide

C10H20N2O3 — CID 66185354

IUPACN-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide
SMILESCC(O)(CO)CNC(=O)C1(C)CCNC1
InChIInChI=1S/C10H20N2O3/c1-9(3-4-11-5-9)8(14)12-6-10(2,15)7-13/h11,13,15H,3-7H2,1-2H3,(H,12,14)
InChIKeyIWJXZHBNPHUYLJ-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.15
Rot. Bonds4

About N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide

N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 66185354) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide
PubChem CID66185354
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide
SMILESCC(O)(CO)CNC(=O)C1(C)CCNC1
InChIInChI=1S/C10H20N2O3/c1-9(3-4-11-5-9)8(14)12-6-10(2,15)7-13/h11,13,15H,3-7H2,1-2H3,(H,12,14)
InChIKeyIWJXZHBNPHUYLJ-UHFFFAOYSA-N
XLogP-1.15
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119726405
2-ethyl-2-[[(3-methylpyrrolidine-3-carbonyl)amino]methyl]butanoic acid
CID 113308641
2-hydroxy-2-methyl-3-[(3-methylpiperidine-3-carbonyl)amino]propanoic acid
CID 66177466
N-(3-amino-2-hydroxy-3-oxopropyl)-3-methylpyrrolidine-3-carboxamide
CID 106175529
N-(1-hydroxy-2-methylbutan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 64549727
2-[(3-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63143746
N-(2-hydroxy-2-methylpentyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 106292003
N-(cyclopropylmethyl)-3-methylpyrrolidine-3-carboxamide
CID 63140909
N-[[4-(hydroxymethyl)phenyl]methyl]-3-methylpyrrolidine-3-carboxamide
CID 107231126
3-methyl-N-(2-methyl-2-methylsulfanylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119945555
N-(2-hydroxy-2-methylbutyl)-1-methylcyclopentane-1-carboxamide
CID 79040016
N-[2-(dimethylamino)ethyl]-3-methylpyrrolidine-3-carboxamide
CID 63140487

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide (CID 66185354) is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide is CC(O)(CO)CNC(=O)C1(C)CCNC1.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is IWJXZHBNPHUYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-9(3-4-11-5-9)8(14)12-6-10(2,15)7-13/h11,13,15H,3-7H2,1-2H3,(H,12,14).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide?
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -1.15, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 66185354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).