6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

C20H23N3O2 — CID 91949112

IUPAC6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESCCC(NC(=O)C1CN(C(C)=O)Cc2cccnc21)c1ccccc1
InChIInChI=1S/C20H23N3O2/c1-3-18(15-8-5-4-6-9-15)22-20(25)17-13-23(14(2)24)12-16-10-7-11-21-19(16)17/h4-11,17-18H,3,12-13H2,1-2H3,(H,22,25)
InChIKeyTZLLAQJDNCHDCH-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.79
Rot. Bonds4

About 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (PubChem CID 91949112) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound Name6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
PubChem CID91949112
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESCCC(NC(=O)C1CN(C(C)=O)Cc2cccnc21)c1ccccc1
InChIInChI=1S/C20H23N3O2/c1-3-18(15-8-5-4-6-9-15)22-20(25)17-13-23(14(2)24)12-16-10-7-11-21-19(16)17/h4-11,17-18H,3,12-13H2,1-2H3,(H,22,25)
InChIKeyTZLLAQJDNCHDCH-UHFFFAOYSA-N
XLogP2.79
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-acetyl-N-(1-pyridin-2-ylethyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949302
6-acetyl-N-[2-(4-ethylsulfonylpiperazin-1-yl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949173
1-[8-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
CID 91949310
6-acetyl-N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949207
1-[8-(2-methylpiperidine-1-carbonyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
CID 91949232
1-[8-(4-propan-2-ylsulfonylpiperazine-1-carbonyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
CID 91949181
N-[(1S)-1-phenylpropyl]-1,4-dihydroisoquinoline-4-carboxamide
CID 91327650
6-acetyl-N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl]-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949189
1-[8-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
CID 91949318
1-methyl-N-(1-phenylpropyl)piperidine-4-carboxamide
CID 50875269
N-[5-(dimethylamino)pentan-2-yl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
CID 91949554
N-(1-phenylpropyl)pyridine-2-carboxamide
CID 5305559

Frequently Asked Questions

What is the IUPAC name of 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The IUPAC name of 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (CID 91949112) is 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is CCC(NC(=O)C1CN(C(C)=O)Cc2cccnc21)c1ccccc1.
What is the InChIKey of 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The InChIKey is TZLLAQJDNCHDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-3-18(15-8-5-4-6-9-15)22-20(25)17-13-23(14(2)24)12-16-10-7-11-21-19(16)17/h4-11,17-18H,3,12-13H2,1-2H3,(H,22,25).
What are the key properties of 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-N-(1-phenylpropyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).