4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide

C16H22N6O2 — CID 162645985

IUPAC4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide
SMILESCC(C)n1cnnc1-c1cccc(NC(=O)C2CN(C)CCO2)n1
InChIInChI=1S/C16H22N6O2/c1-11(2)22-10-17-20-15(22)12-5-4-6-14(18-12)19-16(23)13-9-21(3)7-8-24-13/h4-6,10-11,13H,7-9H2,1-3H3,(H,18,19,23)
InChIKeyFLZBLTCXTGCXPZ-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.19
Rot. Bonds4

About 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide

4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide (PubChem CID 162645985) has the molecular formula C16H22N6O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide
PubChem CID162645985
Molecular FormulaC16H22N6O2
Molecular Weight330.39 g/mol
Exact Mass330.18
IUPAC Name4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide
SMILESCC(C)n1cnnc1-c1cccc(NC(=O)C2CN(C)CCO2)n1
InChIInChI=1S/C16H22N6O2/c1-11(2)22-10-17-20-15(22)12-5-4-6-14(18-12)19-16(23)13-9-21(3)7-8-24-13/h4-6,10-11,13H,7-9H2,1-3H3,(H,18,19,23)
InChIKeyFLZBLTCXTGCXPZ-UHFFFAOYSA-N
XLogP1.19
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide with MolForge

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Related Compounds

N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-[6-(morpholin-4-yl)pyridin-2-yl]pyrimidin-4-yl]acetamide
CID 25069914
N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-{6-[(2-methoxyethyl)(methyl)amino]pyridin-2-yl}pyrimidin-4-yl]acetamide
CID 25074004
N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-[6-(3-methoxyazetidin-1-yl)pyridin-2-yl]pyrimidin-4-yl]acetamide
CID 25138091
N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-[4-(morpholin-4-yl)pyridin-2-yl]pyrimidin-4-yl]acetamide
CID 25069599
(2R)-4-(6-cyclopropyl-3-pyridinyl)-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide
CID 162647791
1-[6-(4-Propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]-3-pyridin-4-ylurea
CID 151600727
1-[6-(4-Propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]-3-pyridin-2-ylurea
CID 151737186
N-[6-((R)-2-Methoxymethylpyrrolidin-1-yl)-2-pyridin-2-ylpyrimidin-4-yl]acetamide
CID 25208258
N-[6-((S)-2-Methoxymethylpyrrolidin-1-yl)-2-pyridin-2-ylpyrimidin-4-yl]acetamide
CID 25209990
N-pyridin-3-yl-2-[2-(1,2,4-triazol-1-ylmethyl)morpholin-4-yl]acetamide
CID 72141742
propan-2-yl N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]carbamate
CID 162647793
4-phenyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide
CID 162649980

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide?
The IUPAC name of 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide (CID 162645985) is 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide?
The canonical SMILES for 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide is CC(C)n1cnnc1-c1cccc(NC(=O)C2CN(C)CCO2)n1.
What is the InChIKey of 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide?
The InChIKey is FLZBLTCXTGCXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6O2/c1-11(2)22-10-17-20-15(22)12-5-4-6-14(18-12)19-16(23)13-9-21(3)7-8-24-13/h4-6,10-11,13H,7-9H2,1-3H3,(H,18,19,23).
What are the key properties of 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide?
4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]morpholine-2-carboxamide is sourced from PubChem (CID 162645985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).