1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine

C13H20N4 — CID 919843

IUPAC1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine
SMILESCN1CCc2nc3c(c(N)c2C1)CCCN3C
InChIInChI=1S/C13H20N4/c1-16-7-5-11-10(8-16)12(14)9-4-3-6-17(2)13(9)15-11/h3-8H2,1-2H3,(H2,14,15)
InChIKeyGERYXRXAODVZGA-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.03
Rot. Bonds

About 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine

1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine (PubChem CID 919843) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine.

Molecular Properties

Compound Name1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine
PubChem CID919843
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine
SMILESCN1CCc2nc3c(c(N)c2C1)CCCN3C
InChIInChI=1S/C13H20N4/c1-16-7-5-11-10(8-16)12(14)9-4-3-6-17(2)13(9)15-11/h3-8H2,1-2H3,(H2,14,15)
InChIKeyGERYXRXAODVZGA-UHFFFAOYSA-N
XLogP1.03
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine with MolForge

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Related Compounds

2-(3,4-Dihydro-1H-isoquinolin-2-yl)-6-methyl-pyridin-4-ylamine
CID 9878065
2-(3,4-Dihydro-1H-isoquinolin-2-yl)-6-ethyl-pyridin-4-ylamine
CID 9921302
4-(3,4-Dihydro-1H-isoquinolin-2-yl)-6-methyl-pyridin-2-ylamine
CID 17955480
6-benzyl-4-N-butyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-diamine
CID 89752423
6-(4-Methyl-piperazin-1-yl)-1,2,3,4,7,8,9,10-octahydro-phenanthridine
CID 10684566
4-N-butyl-6-(2-phenylethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-diamine
CID 145981439
7-(9-Amino-4-methyl-4,8,10-triazabicyclo[4.4.0]deca-7,9,11-trien-7-yl)-4-methyl-4,8,10-triazabicyclo[4.4.0]deca-7,9,11-trien-9-amine
CID 340848
1-methyl-2,3,4,5,7,8,9,10-octahydro-1H-azepino[2,3-b]quinolin-6-amine
CID 657763
1-(2-Methylpropyl)-3-(piperazin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CID 8056755
6-benzyl-4-N,4-N-diethyl-2-N,2-N-dimethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-diamine
CID 91800555
Pyrimido(4,5-c)isoquinoline-1,3-diamine, 7,8,9,10-tetrahydro-6-methyl-
CID 456188
3-(4-Ethylpiperazin-1-yl)-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CID 8070330

Frequently Asked Questions

What is the IUPAC name of 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine?
The IUPAC name of 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine (CID 919843) is 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine.
What is the SMILES notation for 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine?
The canonical SMILES for 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine is CN1CCc2nc3c(c(N)c2C1)CCCN3C.
What is the InChIKey of 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine?
The InChIKey is GERYXRXAODVZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-16-7-5-11-10(8-16)12(14)9-4-3-6-17(2)13(9)15-11/h3-8H2,1-2H3,(H2,14,15).
What are the key properties of 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine?
1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine has a molecular weight of 232.33 g/mol, XLogP of 1.03, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dimethyl-2,3,4,6,8,9-hexahydropyrido[2,3-b][1,6]naphthyridin-5-amine is sourced from PubChem (CID 919843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).