4-chloro-8-cyclopropyloxy-1,7-naphthyridine

C11H9ClN2O — CID 177053142

IUPAC4-chloro-8-cyclopropyloxy-1,7-naphthyridine
SMILESClc1ccnc2c(OC3CC3)nccc12
InChIInChI=1S/C11H9ClN2O/c12-9-4-6-13-10-8(9)3-5-14-11(10)15-7-1-2-7/h3-7H,1-2H2
InChIKeyAOTYJJILRUAUDG-UHFFFAOYSA-N
MW220.66 g/mol
LogP2.82
Rot. Bonds2

About 4-chloro-8-cyclopropyloxy-1,7-naphthyridine

4-chloro-8-cyclopropyloxy-1,7-naphthyridine (PubChem CID 177053142) has the molecular formula C11H9ClN2O and a molecular weight of 220.66 g/mol. Its IUPAC name is 4-chloro-8-cyclopropyloxy-1,7-naphthyridine.

Molecular Properties

Compound Name4-chloro-8-cyclopropyloxy-1,7-naphthyridine
PubChem CID177053142
Molecular FormulaC11H9ClN2O
Molecular Weight220.66 g/mol
Exact Mass220.04
IUPAC Name4-chloro-8-cyclopropyloxy-1,7-naphthyridine
SMILESClc1ccnc2c(OC3CC3)nccc12
InChIInChI=1S/C11H9ClN2O/c12-9-4-6-13-10-8(9)3-5-14-11(10)15-7-1-2-7/h3-7H,1-2H2
InChIKeyAOTYJJILRUAUDG-UHFFFAOYSA-N
XLogP2.82
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-8-cyclopropyloxy-1,7-naphthyridine?
The IUPAC name of 4-chloro-8-cyclopropyloxy-1,7-naphthyridine (CID 177053142) is 4-chloro-8-cyclopropyloxy-1,7-naphthyridine.
What is the SMILES notation for 4-chloro-8-cyclopropyloxy-1,7-naphthyridine?
The canonical SMILES for 4-chloro-8-cyclopropyloxy-1,7-naphthyridine is Clc1ccnc2c(OC3CC3)nccc12.
What is the InChIKey of 4-chloro-8-cyclopropyloxy-1,7-naphthyridine?
The InChIKey is AOTYJJILRUAUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O/c12-9-4-6-13-10-8(9)3-5-14-11(10)15-7-1-2-7/h3-7H,1-2H2.
What are the key properties of 4-chloro-8-cyclopropyloxy-1,7-naphthyridine?
4-chloro-8-cyclopropyloxy-1,7-naphthyridine has a molecular weight of 220.66 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-8-cyclopropyloxy-1,7-naphthyridine is sourced from PubChem (CID 177053142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).