8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde

C15H19N3O2 — CID 134256062

IUPAC8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde
SMILESCN1CCCc2cc(CN3CCCC3=O)c(C=O)nc21
InChIInChI=1S/C15H19N3O2/c1-17-6-2-4-11-8-12(13(10-19)16-15(11)17)9-18-7-3-5-14(18)20/h8,10H,2-7,9H2,1H3
InChIKeyRJFKWGOZZXORGT-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.40
Rot. Bonds3

About 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde

8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde (PubChem CID 134256062) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde.

Molecular Properties

Compound Name8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde
PubChem CID134256062
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde
SMILESCN1CCCc2cc(CN3CCCC3=O)c(C=O)nc21
InChIInChI=1S/C15H19N3O2/c1-17-6-2-4-11-8-12(13(10-19)16-15(11)17)9-18-7-3-5-14(18)20/h8,10H,2-7,9H2,1H3
InChIKeyRJFKWGOZZXORGT-UHFFFAOYSA-N
XLogP1.40
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

7-formyl-6-[(2-oxopyrrolidin-1-yl)methyl]-N-(1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 118036234
3-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-8-prop-1-en-2-yl-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde
CID 142284773
6-(methylamino)-4-(oxetan-3-ylamino)pyridine-3-carbonitrile;6-[(2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1,7-dicarbaldehyde
CID 142284741
N-[5-cyano-4-(1-methylsulfanylpropan-2-ylamino)-2-pyridinyl]-7-formyl-6-[(2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 146306819
4-(1-methoxypropan-2-yloxy)-6-(methylamino)pyridine-3-carbonitrile;6-[(2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1,7-dicarbaldehyde
CID 142284812
N-[5-cyano-4-(cyclopropylamino)-2-pyridinyl]-7-formyl-6-[(4-methyl-2-oxo-1,4-diazepan-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 145406929
4-(cyclopropylamino)-6-[[2-[7-formyl-6-[(4-methyl-2-oxo-1,4-diazepan-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2-oxoethyl]amino]pyridine-3-carbonitrile
CID 145406868
7-formyl-6-[(4-methyl-2-oxopiperazin-1-yl)methyl]-N-(5-nitro-4-piperidin-1-yl-2-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 130469922
N-[4-(ethylamino)-5-nitro-2-pyridinyl]-7-formyl-6-[(4-methyl-2-oxopiperazin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 130469918
N-[5-cyano-4-(oxolan-3-ylamino)-2-pyridinyl]-7-formyl-6-[(2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 134255889
N-[5-cyano-4-(2-fluoroethoxy)-2-pyridinyl]-7-formyl-6-[(4-methyl-2-oxopiperazin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 118036587
N-[5-cyano-4-(2-cyclopentylsulfanylethylamino)-2-pyridinyl]-7-formyl-6-[(4-methyl-2-oxopiperazin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 146320294

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde?
The IUPAC name of 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde (CID 134256062) is 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde.
What is the SMILES notation for 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde?
The canonical SMILES for 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde is CN1CCCc2cc(CN3CCCC3=O)c(C=O)nc21.
What is the InChIKey of 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde?
The InChIKey is RJFKWGOZZXORGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-17-6-2-4-11-8-12(13(10-19)16-15(11)17)9-18-7-3-5-14(18)20/h8,10H,2-7,9H2,1H3.
What are the key properties of 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde?
8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde has a molecular weight of 273.34 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carbaldehyde is sourced from PubChem (CID 134256062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).