3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline

C24H25N5O2 — CID 151659080

IUPAC3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline
SMILESCOc1cc2ccc(-c3nc(C)ccc3-c3cnn(CCC4CCOC4)c3)cc2nn1
InChIInChI=1S/C24H25N5O2/c1-16-3-6-21(20-13-25-29(14-20)9-7-17-8-10-31-15-17)24(26-16)19-5-4-18-12-23(30-2)28-27-22(18)11-19/h3-6,11-14,17H,7-10,15H2,1-2H3
InChIKeyQWDLOQRXWHUFSP-UHFFFAOYSA-N
MW415.50 g/mol
LogP4.30
Rot. Bonds6

About 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline

3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline (PubChem CID 151659080) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline.

Molecular Properties

Compound Name3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline
PubChem CID151659080
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC Name3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline
SMILESCOc1cc2ccc(-c3nc(C)ccc3-c3cnn(CCC4CCOC4)c3)cc2nn1
InChIInChI=1S/C24H25N5O2/c1-16-3-6-21(20-13-25-29(14-20)9-7-17-8-10-31-15-17)24(26-16)19-5-4-18-12-23(30-2)28-27-22(18)11-19/h3-6,11-14,17H,7-10,15H2,1-2H3
InChIKeyQWDLOQRXWHUFSP-UHFFFAOYSA-N
XLogP4.30
TPSA74.95 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline with MolForge

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Related Compounds

7-[3-[1-[(2,2-dimethylcyclopropyl)methyl]pyrazol-4-yl]-6-isocyano-2-pyridinyl]-3-methoxycinnoline
CID 162502529
7-[6-isocyano-3-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]-5-methyl-2-pyridinyl]-3-methoxycinnoline
CID 162502525
2-methyl-6-[6-methyl-3-[1-[(1-methylcyclopentyl)methyl]pyrazol-4-yl]-2-pyridinyl]indazole
CID 137373976
7-[3-[1-[(3,3-difluorocyclopentyl)methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]quinoline
CID 137372448
6-(3-methoxycinnolin-7-yl)-2-methyl-5-[1-[[1-(trifluoromethyl)cyclopropyl]methyl]pyrazol-4-yl]pyridine-3-carbonitrile
CID 151796981
3-methoxy-4-[1-(oxan-4-ylmethyl)pyrazol-4-yl]benzonitrile
CID 172914763
7-[3-[1-[(4-methoxyphenyl)methyl]pyrazol-4-yl]-2-pyridinyl]quinoline
CID 137374115
7-[3-[1-(cyclopentylmethyl)pyrazol-4-yl]-6-(difluoromethoxy)-2-pyridinyl]quinoline
CID 137373638
6-(1,2-dimethylbenzimidazol-5-yl)-5-[1-[(3-fluorocyclobutyl)methyl]pyrazol-4-yl]pyridine-2-carbonitrile
CID 137390414
3-methyl-4-[1-(oxan-4-ylmethyl)pyrazol-4-yl]benzonitrile
CID 170855202
1-[2-(oxan-4-yl)ethyl]pyrazol-4-ol
CID 131218916
1-(2-cyclopropylethyl)-4-(2-iodophenyl)pyrazole
CID 79787419

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline?
The IUPAC name of 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline (CID 151659080) is 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline.
What is the SMILES notation for 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline?
The canonical SMILES for 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline is COc1cc2ccc(-c3nc(C)ccc3-c3cnn(CCC4CCOC4)c3)cc2nn1.
What is the InChIKey of 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline?
The InChIKey is QWDLOQRXWHUFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-16-3-6-21(20-13-25-29(14-20)9-7-17-8-10-31-15-17)24(26-16)19-5-4-18-12-23(30-2)28-27-22(18)11-19/h3-6,11-14,17H,7-10,15H2,1-2H3.
What are the key properties of 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline?
3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline has a molecular weight of 415.50 g/mol, XLogP of 4.30, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-7-[6-methyl-3-[1-[2-(oxolan-3-yl)ethyl]pyrazol-4-yl]-2-pyridinyl]cinnoline is sourced from PubChem (CID 151659080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).