N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide

C24H26N4O — CID 167240009

IUPACN-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(-c3cccc(N)c3C)c2C)nc2c1CCNC2
InChIInChI=1S/C24H26N4O/c1-14-12-22(27-23-13-26-11-10-17(14)23)24(29)28-21-9-5-7-19(16(21)3)18-6-4-8-20(25)15(18)2/h4-9,12,26H,10-11,13,25H2,1-3H3,(H,28,29)
InChIKeyFPBGCIZVMYPNHW-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.15
Rot. Bonds3

About N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide

N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide (PubChem CID 167240009) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
PubChem CID167240009
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC NameN-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(-c3cccc(N)c3C)c2C)nc2c1CCNC2
InChIInChI=1S/C24H26N4O/c1-14-12-22(27-23-13-26-11-10-17(14)23)24(29)28-21-9-5-7-19(16(21)3)18-6-4-8-20(25)15(18)2/h4-9,12,26H,10-11,13,25H2,1-3H3,(H,28,29)
InChIKeyFPBGCIZVMYPNHW-UHFFFAOYSA-N
XLogP4.15
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-methyl-3-[2-methyl-3-(4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carbonylamino)phenyl]phenyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carboxamide
CID 139573067
N-[3-[3-[[5-(4-hydroxybutyl)pyridine-2-carbonyl]amino]-2-methylphenyl]-2-methylphenyl]-7-(2-hydroxyethyl)-4-methyl-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide
CID 167644071
N-(3-amino-2-methylphenyl)-5-methylpyrazine-2-carboxamide
CID 16788765
N-[3-[2-chloro-3-[(1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carbonyl)amino]phenyl]-2-methylphenyl]-1,5-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide
CID 135165143
1-methyl-N-(2-methyl-3-propan-2-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
CID 167001250
N-(3-amino-2-methylphenyl)pyrimidine-5-carboxamide
CID 102921234
N-(3-tert-butyl-2-methylphenyl)-1-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-2-carboxamide
CID 164736662
2-[2-chloro-3-[3-[[2-(difluoromethyl)-7-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]pyrido[3,2-d]pyrimidin-4-yl]amino]-2-methylphenyl]phenyl]-1-(4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2-yl)ethanone
CID 167666424
N-(3-amino-2-methylphenyl)-4-cyanobenzamide
CID 16781940
2,4-dimethyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)benzamide
CID 43808455
5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)pyrazine-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The IUPAC name of N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide (CID 167240009) is N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide.
What is the SMILES notation for N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The canonical SMILES for N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide is Cc1cc(C(=O)Nc2cccc(-c3cccc(N)c3C)c2C)nc2c1CCNC2.
What is the InChIKey of N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
The InChIKey is FPBGCIZVMYPNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-14-12-22(27-23-13-26-11-10-17(14)23)24(29)28-21-9-5-7-19(16(21)3)18-6-4-8-20(25)15(18)2/h4-9,12,26H,10-11,13,25H2,1-3H3,(H,28,29).
What are the key properties of N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide?
N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 4.15, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-amino-2-methylphenyl)-2-methylphenyl]-4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridine-2-carboxamide is sourced from PubChem (CID 167240009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).