N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine

C20H21N7 — CID 118504129

IUPACN-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
SMILESCn1cc(-c2cnc3ccc(Nc4cc(C(C)(C)C)cnn4)nc3c2)cn1
InChIInChI=1S/C20H21N7/c1-20(2,3)15-8-19(26-22-11-15)25-18-6-5-16-17(24-18)7-13(9-21-16)14-10-23-27(4)12-14/h5-12H,1-4H3,(H,24,25,26)
InChIKeyURWAEHLRDDFDOM-UHFFFAOYSA-N
MW359.44 g/mol
LogP3.86
Rot. Bonds3

About N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine

N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine (PubChem CID 118504129) has the molecular formula C20H21N7 and a molecular weight of 359.44 g/mol. Its IUPAC name is N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound NameN-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
PubChem CID118504129
Molecular FormulaC20H21N7
Molecular Weight359.44 g/mol
Exact Mass359.19
IUPAC NameN-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
SMILESCn1cc(-c2cnc3ccc(Nc4cc(C(C)(C)C)cnn4)nc3c2)cn1
InChIInChI=1S/C20H21N7/c1-20(2,3)15-8-19(26-22-11-15)25-18-6-5-16-17(24-18)7-13(9-21-16)14-10-23-27(4)12-14/h5-12H,1-4H3,(H,24,25,26)
InChIKeyURWAEHLRDDFDOM-UHFFFAOYSA-N
XLogP3.86
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.44
LogP ≤ 53.86
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-methylpyrazol-4-yl)-N-(4-methylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 118510313
7-(1-methylpyrazol-4-yl)-N-(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine
CID 118497430
5-ethyl-N-[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-1,3,4-thiadiazol-2-amine
CID 90287896
N-[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]-5-propyl-1,3,4-thiadiazol-2-amine
CID 118497376
N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
CID 122184265
2-chloro-7-(1-methylpyrazol-4-yl)-1,5-naphthyridine;7-(1-methylpyrazol-4-yl)-N-pyridin-2-yl-1,5-naphthyridin-2-amine;pyridin-2-amine
CID 162208846
7-[1-(2-piperidin-4-ylethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90288411
7-(1-methylpyrazol-4-yl)-N-(3-nitrophenyl)-1,5-naphthyridin-2-amine
CID 90288925
7-(1-piperidin-4-ylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine;hydrochloride
CID 118497502
5-[[7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-yl]amino]-N-phenyl-1,3,4-thiadiazole-2-sulfonamide
CID 118497468
7-[1-[2-(azetidin-3-yloxy)ethyl]pyrazol-4-yl]-N-(5-pentan-3-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
CID 90289234

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine (CID 118504129) is N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine is Cn1cc(-c2cnc3ccc(Nc4cc(C(C)(C)C)cnn4)nc3c2)cn1.
What is the InChIKey of N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The InChIKey is URWAEHLRDDFDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7/c1-20(2,3)15-8-19(26-22-11-15)25-18-6-5-16-17(24-18)7-13(9-21-16)14-10-23-27(4)12-14/h5-12H,1-4H3,(H,24,25,26).
What are the key properties of N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine has a molecular weight of 359.44 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butylpyridazin-3-yl)-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 118504129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).