2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine

C15H15ClN4 — CID 90288978

IUPAC2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine
SMILESCN1CC(c2cnc3ccc(Cl)nc3c2)=CN1C1CC1
InChIInChI=1S/C15H15ClN4/c1-19-8-11(9-20(19)12-2-3-12)10-6-14-13(17-7-10)4-5-15(16)18-14/h4-7,9,12H,2-3,8H2,1H3
InChIKeyDQGFXDFGPZEHET-UHFFFAOYSA-N
MW286.77 g/mol
LogP2.95
Rot. Bonds2

About 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine

2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine (PubChem CID 90288978) has the molecular formula C15H15ClN4 and a molecular weight of 286.77 g/mol. Its IUPAC name is 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine.

Molecular Properties

Compound Name2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine
PubChem CID90288978
Molecular FormulaC15H15ClN4
Molecular Weight286.77 g/mol
Exact Mass286.10
IUPAC Name2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine
SMILESCN1CC(c2cnc3ccc(Cl)nc3c2)=CN1C1CC1
InChIInChI=1S/C15H15ClN4/c1-19-8-11(9-20(19)12-2-3-12)10-6-14-13(17-7-10)4-5-15(16)18-14/h4-7,9,12H,2-3,8H2,1H3
InChIKeyDQGFXDFGPZEHET-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.77
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-7-[3-(fluoromethyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine
CID 90289071
[4-(6-chloro-1,5-naphthyridin-3-yl)-1-methylpyrazol-3-yl]methanol
CID 90288841
2-chloro-7-[1-methyl-3-(2-methyl-3-pyridinyl)pyrazol-4-yl]-1,5-naphthyridine
CID 90289025
2-chloro-7-[1-methyl-3-(5-methyl-3-pyridinyl)pyrazol-4-yl]-1,5-naphthyridine
CID 90288857
tert-butyl 4-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]piperidine-1-carboxylate
CID 90288181
2-chloro-7-[1-[(1-piperidin-1-ylpiperidin-4-yl)methyl]pyrazol-4-yl]-1,5-naphthyridine
CID 90288693
2-chloro-7-[3-(6-methoxy-3-pyridinyl)-1-methylpyrazol-4-yl]-1,5-naphthyridine
CID 90288377
2-chloro-7-(1-pyridin-3-ylpyrazol-4-yl)-1,5-naphthyridine
CID 90288406
tert-butyl (3R)-3-[4-(6-chloro-1,5-naphthyridin-3-yl)pyrazol-1-yl]pyrrolidine-1-carboxylate
CID 90288629
2-chloro-7-nitro-1,5-naphthyridine
CID 163817652
3-[4-(6-chloro-1,5-naphthyridin-3-yl)-3-methylpyrazol-1-yl]propanal
CID 90289230
2-chloro-7-(2-methyl-3-pyridin-3-yl-1,5-dihydropyrazol-4-yl)-1,5-naphthyridine
CID 90288731

Frequently Asked Questions

What is the IUPAC name of 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine?
The IUPAC name of 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine (CID 90288978) is 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine.
What is the SMILES notation for 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine?
The canonical SMILES for 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine is CN1CC(c2cnc3ccc(Cl)nc3c2)=CN1C1CC1.
What is the InChIKey of 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine?
The InChIKey is DQGFXDFGPZEHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4/c1-19-8-11(9-20(19)12-2-3-12)10-6-14-13(17-7-10)4-5-15(16)18-14/h4-7,9,12H,2-3,8H2,1H3.
What are the key properties of 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine?
2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine has a molecular weight of 286.77 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-7-(1-cyclopropyl-2-methyl-3H-pyrazol-4-yl)-1,5-naphthyridine is sourced from PubChem (CID 90288978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).