N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide

C16H18N2O2 — CID 61043579

IUPACN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)C(C)c2ccc(O)cc2)n1
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-15(17-11)16(20)18(3)12(2)13-7-9-14(19)10-8-13/h4-10,12,19H,1-3H3
InChIKeyHELNNWQENZVJST-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.93
Rot. Bonds3

About N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide

N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide (PubChem CID 61043579) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide
PubChem CID61043579
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)N(C)C(C)c2ccc(O)cc2)n1
InChIInChI=1S/C16H18N2O2/c1-11-5-4-6-15(17-11)16(20)18(3)12(2)13-7-9-14(19)10-8-13/h4-10,12,19H,1-3H3
InChIKeyHELNNWQENZVJST-UHFFFAOYSA-N
XLogP2.93
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminopropan-2-yl)-N,6-dimethylpyridine-2-carboxamide
CID 82507394
3-hydroxy-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044546
N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide
CID 61044427
6-bromo-N-[1-(4-fluorophenyl)ethyl]-N-methylpyridine-2-carboxamide
CID 103874191
3-fluoro-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61043700
6-methyl-N,N-bis(3-methylbutyl)pyridine-2-carboxamide
CID 78848576
4-fluoro-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044668
6-bromo-N-[1-(3,4-difluorophenyl)ethyl]-N-methylpyridine-2-carboxamide
CID 103874208
3-ethyl-N-[1-(4-hydroxyphenyl)ethyl]-N,1-dimethylpyrazole-4-carboxamide
CID 102810761
N-[1-(4-hydroxyphenyl)ethyl]-N,1-dimethylpyrazole-4-carboxamide
CID 54913256
N-[1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
CID 71994211
N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]-N,6-dimethylpyridine-2-carboxamide
CID 96567463

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide (CID 61043579) is N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide.
What is the SMILES notation for N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The canonical SMILES for N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide is Cc1cccc(C(=O)N(C)C(C)c2ccc(O)cc2)n1.
What is the InChIKey of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide?
The InChIKey is HELNNWQENZVJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-5-4-6-15(17-11)16(20)18(3)12(2)13-7-9-14(19)10-8-13/h4-10,12,19H,1-3H3.
What are the key properties of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide?
N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 61043579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).