N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide

C21H23N5O2 — CID 38760833

IUPACN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N3CCOCC3)nc2)n1
InChIInChI=1S/C21H23N5O2/c1-15-13-16(2)26(24-15)19-6-4-3-5-18(19)23-21(27)17-7-8-20(22-14-17)25-9-11-28-12-10-25/h3-8,13-14H,9-12H2,1-2H3,(H,23,27)
InChIKeyXQXZQJDMRKTQAI-UHFFFAOYSA-N
MW377.45 g/mol
LogP2.97
Rot. Bonds4

About N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide

N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 38760833) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide
PubChem CID38760833
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC NameN-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N3CCOCC3)nc2)n1
InChIInChI=1S/C21H23N5O2/c1-15-13-16(2)26(24-15)19-6-4-3-5-18(19)23-21(27)17-7-8-20(22-14-17)25-9-11-28-12-10-25/h3-8,13-14H,9-12H2,1-2H3,(H,23,27)
InChIKeyXQXZQJDMRKTQAI-UHFFFAOYSA-N
XLogP2.97
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 18148178
N-(4-chloro-2-methylphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 34232545
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 43074055
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-ethylbenzamide
CID 38760630
N-(3,4-dimethylphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 17424831
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 43073960
N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide
CID 18149073
N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 18142509
N-(3,4-diaminophenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 86248826
N-(2-methylphenyl)-6-(4-phenylpiperazin-1-yl)pyridine-3-carboxamide
CID 109159582
6-(3,5-dimethylpyrazol-1-yl)-N-(oxan-4-yl)pyridine-3-carboxamide
CID 110091031
N-(4-iodophenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 17489612

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide (CID 38760833) is N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide is Cc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N3CCOCC3)nc2)n1.
What is the InChIKey of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is XQXZQJDMRKTQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c1-15-13-16(2)26(24-15)19-6-4-3-5-18(19)23-21(27)17-7-8-20(22-14-17)25-9-11-28-12-10-25/h3-8,13-14H,9-12H2,1-2H3,(H,23,27).
What are the key properties of N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide?
N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-6-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 38760833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).