6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide

C16H21N5O — CID 134699696

IUPAC6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(N2CC(n3nc(C)cc3C)C2)nc1
InChIInChI=1S/C16H21N5O/c1-4-17-16(22)13-5-6-15(18-8-13)20-9-14(10-20)21-12(3)7-11(2)19-21/h5-8,14H,4,9-10H2,1-3H3,(H,17,22)
InChIKeyUUKPWWTYJWAJAD-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.71
Rot. Bonds4

About 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide

6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide (PubChem CID 134699696) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide
PubChem CID134699696
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide
SMILESCCNC(=O)c1ccc(N2CC(n3nc(C)cc3C)C2)nc1
InChIInChI=1S/C16H21N5O/c1-4-17-16(22)13-5-6-15(18-8-13)20-9-14(10-20)21-12(3)7-11(2)19-21/h5-8,14H,4,9-10H2,1-3H3,(H,17,22)
InChIKeyUUKPWWTYJWAJAD-UHFFFAOYSA-N
XLogP1.71
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,5-dimethylpyrazol-1-yl)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide
CID 86980602
6-[(1S,5S)-6-benzyl-3,6-diazabicyclo[3.2.2]nonan-3-yl]-N-ethylpyridine-3-carboxamide
CID 133121148
N-ethyl-6-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carboxamide
CID 133314214
6-(3,5-dimethylpyrazol-1-yl)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 38024335
N-ethyl-6-[(3R)-3-phenylpiperazin-1-yl]pyridine-3-carboxamide
CID 95105098
5-[5-(ethylcarbamoyl)-2-pyridinyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic acid
CID 50957600
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
N-ethyl-6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyridine-3-carboxamide
CID 135119211
6-(3,5-dimethylpyrazol-1-yl)-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide;dihydrochloride
CID 119513330
6-(3,5-dimethylpyrazol-1-yl)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120827441
N-(3-aminobutyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119498289
6-[(3S)-3-benzyl-5-oxopiperazin-1-yl]-N-ethylpyridine-3-carboxamide
CID 137340358

Frequently Asked Questions

What is the IUPAC name of 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide?
The IUPAC name of 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide (CID 134699696) is 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide?
The canonical SMILES for 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide is CCNC(=O)c1ccc(N2CC(n3nc(C)cc3C)C2)nc1.
What is the InChIKey of 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide?
The InChIKey is UUKPWWTYJWAJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c1-4-17-16(22)13-5-6-15(18-8-13)20-9-14(10-20)21-12(3)7-11(2)19-21/h5-8,14H,4,9-10H2,1-3H3,(H,17,22).
What are the key properties of 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide?
6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide has a molecular weight of 299.38 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-N-ethylpyridine-3-carboxamide is sourced from PubChem (CID 134699696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).