N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide

C12H18N2O3 — CID 79291508

IUPACN-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N(C)CC(C)(C)O)cn1
InChIInChI=1S/C12H18N2O3/c1-12(2,16)8-14(3)11(15)9-5-6-10(17-4)13-7-9/h5-7,16H,8H2,1-4H3
InChIKeyBHHQLJGOHNBETA-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.93
Rot. Bonds4

About N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide

N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide (PubChem CID 79291508) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide
PubChem CID79291508
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N(C)CC(C)(C)O)cn1
InChIInChI=1S/C12H18N2O3/c1-12(2,16)8-14(3)11(15)9-5-6-10(17-4)13-7-9/h5-7,16H,8H2,1-4H3
InChIKeyBHHQLJGOHNBETA-UHFFFAOYSA-N
XLogP0.93
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-N-methyl-6-phenoxypyridine-3-carboxamide
CID 111663059
6-methoxy-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 134031313
N-(1H-imidazol-2-ylmethyl)-6-methoxy-N-methylpyridine-3-carboxamide
CID 63930568
N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-carboxamide
CID 79290970
N-[(5-bromothiophen-2-yl)methyl]-6-methoxy-N-methylpyridine-3-carboxamide
CID 27839528
N-(2-hydroxy-2-methylpropyl)-N-methylbenzamide
CID 13214665
N-(2,2-dimethylpropyl)-N-methyl-6-(methylamino)pyridine-3-carboxamide
CID 62177743
6-methoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]pyridine-3-carboxamide
CID 27016019
N-(2-hydroxy-2-methylpropyl)-N-methyl-4-(2-methylpropoxy)benzamide
CID 79381593
N-(2-hydroxy-2-methylpropyl)-N-methyl-4-prop-2-enoxybenzamide
CID 79380554
N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-6-methoxypyridine-3-carboxamide
CID 24546502
N-ethyl-N-(2-hydroxy-2-methylpropyl)-6-phenoxypyridine-3-carboxamide
CID 111596072

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide (CID 79291508) is N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide is COc1ccc(C(=O)N(C)CC(C)(C)O)cn1.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide?
The InChIKey is BHHQLJGOHNBETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-12(2,16)8-14(3)11(15)9-5-6-10(17-4)13-7-9/h5-7,16H,8H2,1-4H3.
What are the key properties of N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide?
N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-6-methoxy-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 79291508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).