4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide

C23H21N5O — CID 71010177

IUPAC4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2cc(-c3cnn(C)c3)ccc2C)cn1
InChIInChI=1S/C23H21N5O/c1-15-4-5-17(19-12-26-28(3)14-19)10-20(15)18-6-7-22(25-11-18)27-23(29)21-13-24-9-8-16(21)2/h4-14H,1-3H3,(H,25,27,29)
InChIKeyLDXNJRKBMMEKSI-UHFFFAOYSA-N
MW383.46 g/mol
LogP4.41
Rot. Bonds4

About 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide

4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 71010177) has the molecular formula C23H21N5O and a molecular weight of 383.46 g/mol. Its IUPAC name is 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide
PubChem CID71010177
Molecular FormulaC23H21N5O
Molecular Weight383.46 g/mol
Exact Mass383.17
IUPAC Name4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1ccncc1C(=O)Nc1ccc(-c2cc(-c3cnn(C)c3)ccc2C)cn1
InChIInChI=1S/C23H21N5O/c1-15-4-5-17(19-12-26-28(3)14-19)10-20(15)18-6-7-22(25-11-18)27-23(29)21-13-24-9-8-16(21)2/h4-14H,1-3H3,(H,25,27,29)
InChIKeyLDXNJRKBMMEKSI-UHFFFAOYSA-N
XLogP4.41
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.46
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[5-(fluoromethylsulfonyl)-2-methylphenyl]-2-pyridinyl]-4-methylpyridine-3-carboxamide
CID 90227249
4-methyl-N-[5-[2-methyl-5-(2-methyl-1,3-thiazol-4-yl)phenyl]pyrazin-2-yl]pyridine-3-carboxamide
CID 70979582
N-[5-(2-chloro-5-propan-2-yloxyphenyl)-2-pyridinyl]-4-methylpyridine-3-carboxamide
CID 71010092
3-fluoro-N-[5-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridinyl]pyridine-4-carboxamide
CID 58487162
N-[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]pyridine-3-carboxamide
CID 122184262
N-(5-fluoro-2-pyridinyl)-6-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 121263133
1-methyl-N-[5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-6-oxopyrimidine-5-carboxamide
CID 166780718
N-[3-(1-methylpyrazol-4-yl)phenyl]pyridine-4-carboxamide
CID 110482049
4-methyl-1-(1-methylpiperidin-4-yl)sulfonyl-N-[6-(1-methylpyrazol-4-yl)isoquinolin-3-yl]pyrrole-3-carboxamide
CID 170563373
N-(5-bromo-4-methyl-2-pyridinyl)-1-methylpyrazole-4-carboxamide
CID 79729400
methyl 4-[2-amino-5-(1-methylpyrazol-4-yl)-3-pyridinyl]-2-methylbenzoate
CID 118045392
3-(1-methylpyrazol-4-yl)-N-pyridin-4-ylbenzamide
CID 110486276

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide (CID 71010177) is 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide is Cc1ccncc1C(=O)Nc1ccc(-c2cc(-c3cnn(C)c3)ccc2C)cn1.
What is the InChIKey of 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is LDXNJRKBMMEKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O/c1-15-4-5-17(19-12-26-28(3)14-19)10-20(15)18-6-7-22(25-11-18)27-23(29)21-13-24-9-8-16(21)2/h4-14H,1-3H3,(H,25,27,29).
What are the key properties of 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide?
4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 383.46 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[5-[2-methyl-5-(1-methylpyrazol-4-yl)phenyl]-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 71010177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).