6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride

C14H17ClN4 — CID 21219097

IUPAC6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride
SMILESCc1cccnc1-c1cc2c(c(N)n1)NCCC2.Cl
InChIInChI=1S/C14H16N4.ClH/c1-9-4-2-6-16-12(9)11-8-10-5-3-7-17-13(10)14(15)18-11;/h2,4,6,8,17H,3,5,7H2,1H3,(H2,15,18);1H
InChIKeyCJURTPKBDKFDMV-UHFFFAOYSA-N
MW276.77 g/mol
LogP2.81
Rot. Bonds1

About 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride

6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride (PubChem CID 21219097) has the molecular formula C14H17ClN4 and a molecular weight of 276.77 g/mol. Its IUPAC name is 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride.

Molecular Properties

Compound Name6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride
PubChem CID21219097
Molecular FormulaC14H17ClN4
Molecular Weight276.77 g/mol
Exact Mass276.11
IUPAC Name6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride
SMILESCc1cccnc1-c1cc2c(c(N)n1)NCCC2.Cl
InChIInChI=1S/C14H16N4.ClH/c1-9-4-2-6-16-12(9)11-8-10-5-3-7-17-13(10)14(15)18-11;/h2,4,6,8,17H,3,5,7H2,1H3,(H2,15,18);1H
InChIKeyCJURTPKBDKFDMV-UHFFFAOYSA-N
XLogP2.81
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride?
The IUPAC name of 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride (CID 21219097) is 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride.
What is the SMILES notation for 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride?
The canonical SMILES for 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride is Cc1cccnc1-c1cc2c(c(N)n1)NCCC2.Cl.
What is the InChIKey of 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride?
The InChIKey is CJURTPKBDKFDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4.ClH/c1-9-4-2-6-16-12(9)11-8-10-5-3-7-17-13(10)14(15)18-11;/h2,4,6,8,17H,3,5,7H2,1H3,(H2,15,18);1H.
What are the key properties of 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride?
6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride has a molecular weight of 276.77 g/mol, XLogP of 2.81, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methyl-2-pyridinyl)-1,2,3,4-tetrahydro-1,7-naphthyridin-8-amine;hydrochloride is sourced from PubChem (CID 21219097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).