2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine

C21H16N6 — CID 167367044

IUPAC2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccc[nH]4)cc3n2)n1
InChIInChI=1S/C21H16N6/c1-13-4-2-5-19(25-13)21-15(12-24-27-21)17-7-8-18-20(26-17)10-14(11-23-18)16-6-3-9-22-16/h2-12,22H,1H3,(H,24,27)
InChIKeyKRQCJUDTLBYPQF-UHFFFAOYSA-N
MW352.40 g/mol
LogP4.39
Rot. Bonds3

About 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine

2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine (PubChem CID 167367044) has the molecular formula C21H16N6 and a molecular weight of 352.40 g/mol. Its IUPAC name is 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine.

Molecular Properties

Compound Name2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine
PubChem CID167367044
Molecular FormulaC21H16N6
Molecular Weight352.40 g/mol
Exact Mass352.14
IUPAC Name2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccc[nH]4)cc3n2)n1
InChIInChI=1S/C21H16N6/c1-13-4-2-5-19(25-13)21-15(12-24-27-21)17-7-8-18-20(26-17)10-14(11-23-18)16-6-3-9-22-16/h2-12,22H,1H3,(H,24,27)
InChIKeyKRQCJUDTLBYPQF-UHFFFAOYSA-N
XLogP4.39
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
CID 167366670
5-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-1H-pyrimidin-2-one
CID 167367184
N-methyl-6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-amine
CID 167366750
N,N-dimethyl-4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]cyclohex-3-en-1-amine
CID 167366792
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-piperidin-1-yl-1,5-naphthyridine
CID 167367153
4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-N-propan-2-ylcyclohex-3-en-1-amine
CID 167366936
N,N-dimethyl-2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazol-1-yl]ethanamine
CID 167367037
2-[4-[4-fluoro-3-(1H-pyrrol-2-yl)phenyl]-1H-pyrazol-5-yl]-6-methylpyridine
CID 69351052
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyrazin-3-yl)-1,5-naphthyridine
CID 167366496
6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-N-piperidin-4-yl-1,5-naphthyridin-3-amine
CID 167366791
ethyl 2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]triazol-1-yl]acetate
CID 167366749
N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine
CID 167366629

Frequently Asked Questions

What is the IUPAC name of 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine?
The IUPAC name of 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine (CID 167367044) is 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine.
What is the SMILES notation for 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine?
The canonical SMILES for 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine is Cc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccc[nH]4)cc3n2)n1.
What is the InChIKey of 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine?
The InChIKey is KRQCJUDTLBYPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N6/c1-13-4-2-5-19(25-13)21-15(12-24-27-21)17-7-8-18-20(26-17)10-14(11-23-18)16-6-3-9-22-16/h2-12,22H,1H3,(H,24,27).
What are the key properties of 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine?
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine has a molecular weight of 352.40 g/mol, XLogP of 4.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine is sourced from PubChem (CID 167367044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).