N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide

C21H23FN4O2 — CID 167751619

IUPACN-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide
SMILESCc1cc(F)ccc1N1CCCC(NC(=O)N2CCCc3ccncc32)C1=O
InChIInChI=1S/C21H23FN4O2/c1-14-12-16(22)6-7-18(14)25-10-3-5-17(20(25)27)24-21(28)26-11-2-4-15-8-9-23-13-19(15)26/h6-9,12-13,17H,2-5,10-11H2,1H3,(H,24,28)
InChIKeyPPPVPJBBEREHFM-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.19
Rot. Bonds2

About N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide

N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide (PubChem CID 167751619) has the molecular formula C21H23FN4O2 and a molecular weight of 382.44 g/mol. Its IUPAC name is N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide
PubChem CID167751619
Molecular FormulaC21H23FN4O2
Molecular Weight382.44 g/mol
Exact Mass382.18
IUPAC NameN-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide
SMILESCc1cc(F)ccc1N1CCCC(NC(=O)N2CCCc3ccncc32)C1=O
InChIInChI=1S/C21H23FN4O2/c1-14-12-16(22)6-7-18(14)25-10-3-5-17(20(25)27)24-21(28)26-11-2-4-15-8-9-23-13-19(15)26/h6-9,12-13,17H,2-5,10-11H2,1H3,(H,24,28)
InChIKeyPPPVPJBBEREHFM-UHFFFAOYSA-N
XLogP3.19
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-fluoro-2-methylphenyl)-3-(oxan-4-ylamino)piperidin-2-one
CID 118740667
(3S)-3-amino-1-(4-fluoro-2-methylphenyl)piperidin-2-one
CID 95240490
N-cyclopentyl-6-fluoro-3,4-dihydro-2H-quinoline-1-carboxamide
CID 110747475
3-[(3S)-1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3-oxopropanenitrile
CID 125449544
N-[1-(2,4-difluorophenyl)-2-oxopiperidin-3-yl]-1,4,5-oxadiazepane-4-carboxamide
CID 155958205
N-(3-fluorophenyl)-N'-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679287
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2-carboxamide
CID 42140131
[1-(4-bromo-2,3-difluorophenyl)-2-oxopiperidin-3-yl]carbamic acid
CID 155415178
1-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-3-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea
CID 133215227
2-amino-N-[1-(4-fluoro-2-methylphenyl)piperidin-3-yl]acetamide
CID 119883950
1-[(3R)-1-(3-fluorophenyl)-2-oxopiperidin-3-yl]-3-(pyridin-4-ylmethyl)urea
CID 95629087
1-[(4-fluorophenyl)methyl]-3-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]urea
CID 38203655

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide?
The IUPAC name of N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide (CID 167751619) is N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide.
What is the SMILES notation for N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide?
The canonical SMILES for N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide is Cc1cc(F)ccc1N1CCCC(NC(=O)N2CCCc3ccncc32)C1=O.
What is the InChIKey of N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide?
The InChIKey is PPPVPJBBEREHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23FN4O2/c1-14-12-16(22)6-7-18(14)25-10-3-5-17(20(25)27)24-21(28)26-11-2-4-15-8-9-23-13-19(15)26/h6-9,12-13,17H,2-5,10-11H2,1H3,(H,24,28).
What are the key properties of N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide?
N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide has a molecular weight of 382.44 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluoro-2-methylphenyl)-2-oxopiperidin-3-yl]-3,4-dihydro-2H-1,7-naphthyridine-1-carboxamide is sourced from PubChem (CID 167751619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).