N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide

C16H18N2O2 — CID 61044427

IUPACN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)C(C)c2ccc(O)cc2)cn1
InChIInChI=1S/C16H18N2O2/c1-11-4-5-14(10-17-11)16(20)18(3)12(2)13-6-8-15(19)9-7-13/h4-10,12,19H,1-3H3
InChIKeyYNXALTICWVNKIV-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.93
Rot. Bonds3

About N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide

N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide (PubChem CID 61044427) 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-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide
PubChem CID61044427
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)C(C)c2ccc(O)cc2)cn1
InChIInChI=1S/C16H18N2O2/c1-11-4-5-14(10-17-11)16(20)18(3)12(2)13-6-8-15(19)9-7-13/h4-10,12,19H,1-3H3
InChIKeyYNXALTICWVNKIV-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,6-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 134054395
4-fluoro-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044668
N-[1-(4-hydroxyphenyl)ethyl]-N,1-dimethylpyrazole-4-carboxamide
CID 54913256
N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide
CID 38551924
N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-2-carboxamide
CID 61043579
6-bromo-N-[1-(4-fluorophenyl)ethyl]-N-methylpyridine-3-carboxamide
CID 66462106
3-hydroxy-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044546
N-[1-(4-chlorophenyl)ethyl]-6-methoxy-N-methylpyridine-3-carboxamide
CID 134003966
6-methoxy-N-methyl-N-(1-phenylethyl)pyridine-3-carboxamide
CID 134031462
3-fluoro-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61043700
methyl (2R)-2-[methyl-(6-methylpyridine-3-carbonyl)amino]-2-phenylacetate
CID 95980810
N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
CID 60737715

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide (CID 61044427) is N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)N(C)C(C)c2ccc(O)cc2)cn1.
What is the InChIKey of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is YNXALTICWVNKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-4-5-14(10-17-11)16(20)18(3)12(2)13-6-8-15(19)9-7-13/h4-10,12,19H,1-3H3.
What are the key properties of N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-carboxamide?
N-[1-(4-hydroxyphenyl)ethyl]-N,6-dimethylpyridine-3-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-3-carboxamide is sourced from PubChem (CID 61044427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).