3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride

C10H15Cl2N3O — CID 69232619

IUPAC3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride
SMILESCCN1C(=O)C(N)Cc2cccnc21.Cl.Cl
InChIInChI=1S/C10H13N3O.2ClH/c1-2-13-9-7(4-3-5-12-9)6-8(11)10(13)14;;/h3-5,8H,2,6,11H2,1H3;2*1H
InChIKeyPMYFPWHCXUDLNM-UHFFFAOYSA-N
MW264.16 g/mol
LogP1.16
Rot. Bonds1

About 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride

3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride (PubChem CID 69232619) has the molecular formula C10H15Cl2N3O and a molecular weight of 264.16 g/mol. Its IUPAC name is 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride.

Molecular Properties

Compound Name3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride
PubChem CID69232619
Molecular FormulaC10H15Cl2N3O
Molecular Weight264.16 g/mol
Exact Mass263.06
IUPAC Name3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride
SMILESCCN1C(=O)C(N)Cc2cccnc21.Cl.Cl
InChIInChI=1S/C10H13N3O.2ClH/c1-2-13-9-7(4-3-5-12-9)6-8(11)10(13)14;;/h3-5,8H,2,6,11H2,1H3;2*1H
InChIKeyPMYFPWHCXUDLNM-UHFFFAOYSA-N
XLogP1.16
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.16
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride?
The IUPAC name of 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride (CID 69232619) is 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride.
What is the SMILES notation for 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride?
The canonical SMILES for 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride is CCN1C(=O)C(N)Cc2cccnc21.Cl.Cl.
What is the InChIKey of 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride?
The InChIKey is PMYFPWHCXUDLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O.2ClH/c1-2-13-9-7(4-3-5-12-9)6-8(11)10(13)14;;/h3-5,8H,2,6,11H2,1H3;2*1H.
What are the key properties of 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride?
3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride has a molecular weight of 264.16 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-ethyl-3,4-dihydro-1,8-naphthyridin-2-one;dihydrochloride is sourced from PubChem (CID 69232619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).