2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine

C19H27N3 — CID 82450829

IUPAC2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine
SMILESCCN1CCc2nc3c(C)cc(C)cc3c(C(C)(C)N)c2C1
InChIInChI=1S/C19H27N3/c1-6-22-8-7-16-15(11-22)17(19(4,5)20)14-10-12(2)9-13(3)18(14)21-16/h9-10H,6-8,11,20H2,1-5H3
InChIKeyAFUBVPTVCDVFFR-UHFFFAOYSA-N
MW297.45 g/mol
LogP3.42
Rot. Bonds2

About 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine

2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine (PubChem CID 82450829) has the molecular formula C19H27N3 and a molecular weight of 297.45 g/mol. Its IUPAC name is 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine.

Molecular Properties

Compound Name2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine
PubChem CID82450829
Molecular FormulaC19H27N3
Molecular Weight297.45 g/mol
Exact Mass297.22
IUPAC Name2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine
SMILESCCN1CCc2nc3c(C)cc(C)cc3c(C(C)(C)N)c2C1
InChIInChI=1S/C19H27N3/c1-6-22-8-7-16-15(11-22)17(19(4,5)20)14-10-12(2)9-13(3)18(14)21-16/h9-10H,6-8,11,20H2,1-5H3
InChIKeyAFUBVPTVCDVFFR-UHFFFAOYSA-N
XLogP3.42
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine with MolForge

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Related Compounds

(2-ethyl-7,9-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82450935
2-ethyl-7,9-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbohydrazide
CID 82450941
2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine
CID 82452395
2-ethyl-6-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbonitrile
CID 82450077
2-ethyl-8-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbohydrazide
CID 82450420
1-(2-ethyl-7,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)ethanone
CID 82451050
N-[(2-ethyl-6-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methyl]propan-1-amine
CID 82450082
2-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-4,6-dimethyl-1,3-benzothiazole
CID 95910445
(2,6-diethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82450203
2,6-diethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbohydrazide
CID 82450209
6,7-dichloro-2-ethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid
CID 60984693
1-(7-chloro-2-ethyl-6-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)-N-methylmethanamine
CID 82451762

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine?
The IUPAC name of 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine (CID 82450829) is 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine.
What is the SMILES notation for 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine?
The canonical SMILES for 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine is CCN1CCc2nc3c(C)cc(C)cc3c(C(C)(C)N)c2C1.
What is the InChIKey of 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine?
The InChIKey is AFUBVPTVCDVFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3/c1-6-22-8-7-16-15(11-22)17(19(4,5)20)14-10-12(2)9-13(3)18(14)21-16/h9-10H,6-8,11,20H2,1-5H3.
What are the key properties of 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine?
2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine has a molecular weight of 297.45 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-6,8-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)propan-2-amine is sourced from PubChem (CID 82450829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).