1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride

C8H12Cl2N2 — CID 142419123

IUPAC1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride
SMILESCl.Cl.c1cnc2c(c1)CCCN2
InChIInChI=1S/C8H10N2.2ClH/c1-3-7-4-2-6-10-8(7)9-5-1;;/h1,3,5H,2,4,6H2,(H,9,10);2*1H
InChIKeySJWKTAPOPSSMDK-UHFFFAOYSA-N
MW207.10 g/mol
LogP2.28
Rot. Bonds

About 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride

1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride (PubChem CID 142419123) has the molecular formula C8H12Cl2N2 and a molecular weight of 207.10 g/mol. Its IUPAC name is 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride.

Molecular Properties

Compound Name1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride
PubChem CID142419123
Molecular FormulaC8H12Cl2N2
Molecular Weight207.10 g/mol
Exact Mass206.04
IUPAC Name1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride
SMILESCl.Cl.c1cnc2c(c1)CCCN2
InChIInChI=1S/C8H10N2.2ClH/c1-3-7-4-2-6-10-8(7)9-5-1;;/h1,3,5H,2,4,6H2,(H,9,10);2*1H
InChIKeySJWKTAPOPSSMDK-UHFFFAOYSA-N
XLogP2.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.10
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride?
The IUPAC name of 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride (CID 142419123) is 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride.
What is the SMILES notation for 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride?
The canonical SMILES for 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride is Cl.Cl.c1cnc2c(c1)CCCN2.
What is the InChIKey of 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride?
The InChIKey is SJWKTAPOPSSMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.2ClH/c1-3-7-4-2-6-10-8(7)9-5-1;;/h1,3,5H,2,4,6H2,(H,9,10);2*1H.
What are the key properties of 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride?
1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride has a molecular weight of 207.10 g/mol, XLogP of 2.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydro-1,8-naphthyridine;dihydrochloride is sourced from PubChem (CID 142419123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).