N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide

C18H21N3O2 — CID 84570217

IUPACN-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide
SMILESCN(C(=O)c1ccc(N2CCCCC2)nc1)c1ccc(O)cc1
InChIInChI=1S/C18H21N3O2/c1-20(15-6-8-16(22)9-7-15)18(23)14-5-10-17(19-13-14)21-11-3-2-4-12-21/h5-10,13,22H,2-4,11-12H2,1H3
InChIKeyMSINJWIJWKIERB-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.05
Rot. Bonds3

About N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide

N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 84570217) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide
PubChem CID84570217
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC NameN-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide
SMILESCN(C(=O)c1ccc(N2CCCCC2)nc1)c1ccc(O)cc1
InChIInChI=1S/C18H21N3O2/c1-20(15-6-8-16(22)9-7-15)18(23)14-5-10-17(19-13-14)21-11-3-2-4-12-21/h5-10,13,22H,2-4,11-12H2,1H3
InChIKeyMSINJWIJWKIERB-UHFFFAOYSA-N
XLogP3.05
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxyphenyl)-N-methyl-6-morpholin-4-ylpyridine-3-carboxamide
CID 84570914
6-piperidin-1-ylpyridine-3-carboxylic acid
CID 2794761
2-[methyl-(6-pyrrolidin-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 119358653
6-piperidin-1-ylpyridine-3-carboxamide;dihydrochloride
CID 69276901
6-(azepan-1-yl)-N-methyl-N-(4-phenylbutyl)pyridine-3-carboxamide
CID 112837376
2-methyl-1-(6-pyrrolidin-1-yl-3-pyridinyl)propan-1-one
CID 83888261
N-methyl-6-pyrrolidin-1-yl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119550921
3-[6-(azepan-1-yl)-3-pyridinyl]-N,N-dimethylbenzamide
CID 53150002
6-(azepan-1-yl)-N-(4-hydroxy-2-methylpentyl)pyridine-3-carboxamide
CID 111447123
6-(azepan-1-yl)-N-[(3-ethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide
CID 136545370
N-(2-aminoethyl)-6-(azepan-1-yl)pyridine-3-carboxamide
CID 119382780
6-(azepan-1-yl)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methylpyridine-3-carboxamide
CID 39556788

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide (CID 84570217) is N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide is CN(C(=O)c1ccc(N2CCCCC2)nc1)c1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is MSINJWIJWKIERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-20(15-6-8-16(22)9-7-15)18(23)14-5-10-17(19-13-14)21-11-3-2-4-12-21/h5-10,13,22H,2-4,11-12H2,1H3.
What are the key properties of N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide?
N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 311.38 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-N-methyl-6-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 84570217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).