N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide

C11H22N2O3 — CID 79160357

IUPACN-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCC(C)(O)CO)C1
InChIInChI=1S/C11H22N2O3/c1-9-4-3-5-13(6-9)10(15)12-7-11(2,16)8-14/h9,14,16H,3-8H2,1-2H3,(H,12,15)
InChIKeyWULFDPYMBFWLTR-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.17
Rot. Bonds3

About N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide

N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide (PubChem CID 79160357) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide
PubChem CID79160357
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCC(C)(O)CO)C1
InChIInChI=1S/C11H22N2O3/c1-9-4-3-5-13(6-9)10(15)12-7-11(2,16)8-14/h9,14,16H,3-8H2,1-2H3,(H,12,15)
InChIKeyWULFDPYMBFWLTR-UHFFFAOYSA-N
XLogP0.17
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxy-2,2-dimethylpentyl)-3-methylpiperidine-1-carboxamide
CID 111507279
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-(2,2-dimethylheptyl)-3-methylpiperidine-1-carboxamide
CID 116656850
3-hydroxy-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]piperidine-1-carboxamide
CID 110903346
3-(hydroxymethyl)-N-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]pyrrolidine-1-carboxamide
CID 111443816
3-hydroxy-4-[(3-methoxycarbonylpiperidine-1-carbonyl)amino]-3-methylbutanoic acid
CID 115535255
3-methyl-N-prop-2-ynylpiperidine-1-carboxamide
CID 112722495
3-methyl-N-prop-2-enylpiperidine-1-carboxamide
CID 108987828
3-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]piperidine-1-carboxamide
CID 116654402
N-[[2-(aminomethyl)cyclohexyl]methyl]-3-methylpiperidine-1-carboxamide
CID 79163504
N-(4-amino-4-oxobutyl)-3-methylpiperidine-1-carboxamide
CID 115584144
N-(2-hydroxy-2-methylpentyl)-4-methylpiperidine-1-carboxamide
CID 106290239

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide (CID 79160357) is N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide is CC1CCCN(C(=O)NCC(C)(O)CO)C1.
What is the InChIKey of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide?
The InChIKey is WULFDPYMBFWLTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9-4-3-5-13(6-9)10(15)12-7-11(2,16)8-14/h9,14,16H,3-8H2,1-2H3,(H,12,15).
What are the key properties of N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide?
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpiperidine-1-carboxamide has a molecular weight of 230.31 g/mol, XLogP of 0.17, 3 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-methylpiperidine-1-carboxamide is sourced from PubChem (CID 79160357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).