N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide

C19H18N6O — CID 146592216

IUPACN-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(-c3ccccc3)cc12
InChIInChI=1S/C19H18N6O/c1-20-19(26)14-11-21-18(23-16-8-9-25(2)24-16)17-13(14)10-15(22-17)12-6-4-3-5-7-12/h3-11,22H,1-2H3,(H,20,26)(H,21,23,24)
InChIKeyOSNYGJJMISCIGX-UHFFFAOYSA-N
MW346.39 g/mol
LogP3.07
Rot. Bonds4

About N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide

N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide (PubChem CID 146592216) has the molecular formula C19H18N6O and a molecular weight of 346.39 g/mol. Its IUPAC name is N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
PubChem CID146592216
Molecular FormulaC19H18N6O
Molecular Weight346.39 g/mol
Exact Mass346.15
IUPAC NameN-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(-c3ccccc3)cc12
InChIInChI=1S/C19H18N6O/c1-20-19(26)14-11-21-18(23-16-8-9-25(2)24-16)17-13(14)10-15(22-17)12-6-4-3-5-7-12/h3-11,22H,1-2H3,(H,20,26)(H,21,23,24)
InChIKeyOSNYGJJMISCIGX-UHFFFAOYSA-N
XLogP3.07
TPSA87.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 53.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The IUPAC name of N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide (CID 146592216) is N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide.
What is the SMILES notation for N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The canonical SMILES for N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide is CNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(-c3ccccc3)cc12.
What is the InChIKey of N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The InChIKey is OSNYGJJMISCIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O/c1-20-19(26)14-11-21-18(23-16-8-9-25(2)24-16)17-13(14)10-15(22-17)12-6-4-3-5-7-12/h3-11,22H,1-2H3,(H,20,26)(H,21,23,24).
What are the key properties of N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 3.07, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7-[(1-methylpyrazol-3-yl)amino]-2-phenyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide is sourced from PubChem (CID 146592216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).