N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide

C17H19N3O — CID 167755688

IUPACN-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide
SMILESCN1CCc2nc3ccccc3c(NC(=O)C3CC3)c2C1
InChIInChI=1S/C17H19N3O/c1-20-9-8-15-13(10-20)16(19-17(21)11-6-7-11)12-4-2-3-5-14(12)18-15/h2-5,11H,6-10H2,1H3,(H,18,19,21)
InChIKeySCGAZWACIQCGFI-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.57
Rot. Bonds2

About N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide

N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide (PubChem CID 167755688) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide
PubChem CID167755688
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide
SMILESCN1CCc2nc3ccccc3c(NC(=O)C3CC3)c2C1
InChIInChI=1S/C17H19N3O/c1-20-9-8-15-13(10-20)16(19-17(21)11-6-7-11)12-4-2-3-5-14(12)18-15/h2-5,11H,6-10H2,1H3,(H,18,19,21)
InChIKeySCGAZWACIQCGFI-UHFFFAOYSA-N
XLogP2.57
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)cyclopropanecarboxamide
CID 167911317
2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxamide
CID 933509
N-methyl-1-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82449912
(2-anilino-2-oxoethyl) 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23915561
(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanethiol
CID 82449929
3-(cyclopropanecarbonylamino)-1-methylindole-2-carboxylic acid
CID 155961141
[2-(2,3-dichloroanilino)-2-oxoethyl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23962126
[(2S)-1-[[(1R,2S,3R)-2,3-dimethylcyclohexyl]amino]-1-oxopropan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 100851615
[(2S)-1-[[(1R,2S,3S)-2,3-dimethylcyclohexyl]amino]-1-oxopropan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 98314418
[(2S)-1-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]amino]-1-oxopropan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 124719667
(8-chloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)hydrazine
CID 15631971
[1-(4-methoxyanilino)-1-oxopropan-2-yl] 2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate
CID 23860134

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide?
The IUPAC name of N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide (CID 167755688) is N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide is CN1CCc2nc3ccccc3c(NC(=O)C3CC3)c2C1.
What is the InChIKey of N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide?
The InChIKey is SCGAZWACIQCGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-20-9-8-15-13(10-20)16(19-17(21)11-6-7-11)12-4-2-3-5-14(12)18-15/h2-5,11H,6-10H2,1H3,(H,18,19,21).
What are the key properties of N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide?
N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide has a molecular weight of 281.36 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)cyclopropanecarboxamide is sourced from PubChem (CID 167755688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).