2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide

C14H15N3O — CID 933509

IUPAC2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
SMILESCN1CCc2nc3ccccc3c(C(N)=O)c2C1
InChIInChI=1S/C14H15N3O/c1-17-7-6-12-10(8-17)13(14(15)18)9-4-2-3-5-11(9)16-12/h2-5H,6-8H2,1H3,(H2,15,18)
InChIKeyFTHABYPYJKKXLY-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.32
Rot. Bonds1

About 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide

2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide (PubChem CID 933509) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide.

Molecular Properties

Compound Name2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
PubChem CID933509
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
SMILESCN1CCc2nc3ccccc3c(C(N)=O)c2C1
InChIInChI=1S/C14H15N3O/c1-17-7-6-12-10(8-17)13(14(15)18)9-4-2-3-5-11(9)16-12/h2-5H,6-8H2,1H3,(H2,15,18)
InChIKeyFTHABYPYJKKXLY-UHFFFAOYSA-N
XLogP1.32
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-amino-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
CID 110489469
6-amino-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
CID 110489471
(2-anilino-2-oxoethyl) 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23915561
[2-(4-methoxyphenyl)-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 2424741
N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide
CID 167755688
(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanethiol
CID 82449929
[2-(2,3-dichloroanilino)-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23962126
[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23770076
[1-(4-methoxyanilino)-1-oxopropan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23860134
[1-(4-acetamidoanilino)-1-oxobutan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23774140
N-methyl-1-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82449912
[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23744542

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide?
The IUPAC name of 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide (CID 933509) is 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide.
What is the SMILES notation for 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide?
The canonical SMILES for 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide is CN1CCc2nc3ccccc3c(C(N)=O)c2C1.
What is the InChIKey of 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide?
The InChIKey is FTHABYPYJKKXLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-17-7-6-12-10(8-17)13(14(15)18)9-4-2-3-5-11(9)16-12/h2-5H,6-8H2,1H3,(H2,15,18).
What are the key properties of 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide?
2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide is sourced from PubChem (CID 933509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).