2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine

C14H23N3 — CID 82452395

IUPAC2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine
SMILESCCN1CCc2nc(C)c(C(C)(C)N)cc2C1
InChIInChI=1S/C14H23N3/c1-5-17-7-6-13-11(9-17)8-12(10(2)16-13)14(3,4)15/h8H,5-7,9,15H2,1-4H3
InChIKeySBIOSZOETNVLRH-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.96
Rot. Bonds2

About 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine

2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine (PubChem CID 82452395) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine.

Molecular Properties

Compound Name2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine
PubChem CID82452395
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine
SMILESCCN1CCc2nc(C)c(C(C)(C)N)cc2C1
InChIInChI=1S/C14H23N3/c1-5-17-7-6-13-11(9-17)8-12(10(2)16-13)14(3,4)15/h8H,5-7,9,15H2,1-4H3
InChIKeySBIOSZOETNVLRH-UHFFFAOYSA-N
XLogP1.96
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine?
The IUPAC name of 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine (CID 82452395) is 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine.
What is the SMILES notation for 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine?
The canonical SMILES for 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine is CCN1CCc2nc(C)c(C(C)(C)N)cc2C1.
What is the InChIKey of 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine?
The InChIKey is SBIOSZOETNVLRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-5-17-7-6-13-11(9-17)8-12(10(2)16-13)14(3,4)15/h8H,5-7,9,15H2,1-4H3.
What are the key properties of 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine?
2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine has a molecular weight of 233.36 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine is sourced from PubChem (CID 82452395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).