7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine

C21H23N7 — CID 118504254

IUPAC7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine
SMILESCc1nn(C)cc1-c1cnc2ccc(Nc3cc(CC(C)C)cnn3)nc2c1
InChIInChI=1S/C21H23N7/c1-13(2)7-15-8-21(26-23-10-15)25-20-6-5-18-19(24-20)9-16(11-22-18)17-12-28(4)27-14(17)3/h5-6,8-13H,7H2,1-4H3,(H,24,25,26)
InChIKeyMRKQOSJCMNCBKF-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.07
Rot. Bonds5

About 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine

7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine (PubChem CID 118504254) has the molecular formula C21H23N7 and a molecular weight of 373.46 g/mol. Its IUPAC name is 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine
PubChem CID118504254
Molecular FormulaC21H23N7
Molecular Weight373.46 g/mol
Exact Mass373.20
IUPAC Name7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine
SMILESCc1nn(C)cc1-c1cnc2ccc(Nc3cc(CC(C)C)cnn3)nc2c1
InChIInChI=1S/C21H23N7/c1-13(2)7-15-8-21(26-23-10-15)25-20-6-5-18-19(24-20)9-16(11-22-18)17-12-28(4)27-14(17)3/h5-6,8-13H,7H2,1-4H3,(H,24,25,26)
InChIKeyMRKQOSJCMNCBKF-UHFFFAOYSA-N
XLogP4.07
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-(2-methylpropyl)pyridazin-3-yl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
CID 118504173
7-(1,3-dimethylpyrazol-4-yl)-N-(5-prop-1-en-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90289380
7-(1,3-dimethylpyrazol-4-yl)-N-(1-propan-2-ylimidazol-4-yl)-1,5-naphthyridin-2-amine
CID 90289452
7-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90288861
7-(1-methyl-3-morpholin-4-ylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90289306
7-(1-methyl-3-pyridazin-4-ylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 118497353
7-[1-methyl-3-(4-methyl-3-pyridinyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90289457
7-[1-methyl-3-[[methyl(pyridin-3-yl)amino]methyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 118510246
7-[3-[4-[2-(dimethylamino)ethoxy]phenyl]-1-methylpyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 118504246
7-[3-(6-methoxy-3-pyridinyl)-1-methylpyrazol-4-yl]-N-(5-methylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90288333
N,N-dimethyl-2-[3-[[1-methyl-4-[6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridin-3-yl]pyrazol-3-yl]methoxy]phenoxy]acetamide
CID 90289483
N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
CID 118504129

Frequently Asked Questions

What is the IUPAC name of 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine?
The IUPAC name of 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine (CID 118504254) is 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine.
What is the SMILES notation for 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine?
The canonical SMILES for 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine is Cc1nn(C)cc1-c1cnc2ccc(Nc3cc(CC(C)C)cnn3)nc2c1.
What is the InChIKey of 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine?
The InChIKey is MRKQOSJCMNCBKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N7/c1-13(2)7-15-8-21(26-23-10-15)25-20-6-5-18-19(24-20)9-16(11-22-18)17-12-28(4)27-14(17)3/h5-6,8-13H,7H2,1-4H3,(H,24,25,26).
What are the key properties of 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine?
7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine has a molecular weight of 373.46 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,3-dimethylpyrazol-4-yl)-N-[5-(2-methylpropyl)pyridazin-3-yl]-1,5-naphthyridin-2-amine is sourced from PubChem (CID 118504254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).