2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide

C26H30N4O3 — CID 92620984

IUPAC2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc3c(nc2N)CCN(Cc2cccc(C)c2OC)C3)c1
InChIInChI=1S/C26H30N4O3/c1-17-6-4-8-19(24(17)33-3)15-30-11-10-23-20(16-30)13-22(25(27)29-23)26(31)28-14-18-7-5-9-21(12-18)32-2/h4-9,12-13H,10-11,14-16H2,1-3H3,(H2,27,29)(H,28,31)
InChIKeyYLGAFGXJYCSPBL-UHFFFAOYSA-N
MW446.55 g/mol
LogP3.48
Rot. Bonds7

About 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide

2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide (PubChem CID 92620984) has the molecular formula C26H30N4O3 and a molecular weight of 446.55 g/mol. Its IUPAC name is 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
PubChem CID92620984
Molecular FormulaC26H30N4O3
Molecular Weight446.55 g/mol
Exact Mass446.23
IUPAC Name2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2cc3c(nc2N)CCN(Cc2cccc(C)c2OC)C3)c1
InChIInChI=1S/C26H30N4O3/c1-17-6-4-8-19(24(17)33-3)15-30-11-10-23-20(16-30)13-22(25(27)29-23)26(31)28-14-18-7-5-9-21(12-18)32-2/h4-9,12-13H,10-11,14-16H2,1-3H3,(H2,27,29)(H,28,31)
InChIKeyYLGAFGXJYCSPBL-UHFFFAOYSA-N
XLogP3.48
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.55
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-N-[(3-methoxyphenyl)methyl]-6-[(2S)-oxolane-2-carbonyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
CID 92621093
2-amino-N-benzyl-6-(diethylsulfamoyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide
CID 92620847
2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridine
CID 24731661
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
N-benzyl-6-[(3-methoxyphenyl)methyl]-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
CID 155875363
2-[(2,5-dioxoimidazolidin-1-yl)methyl]-N-[(3-methoxyphenyl)methyl]benzamide
CID 17433808
5-amino-N-[(3-methoxyphenyl)methyl]-1-[2-(2-methylanilino)-2-oxoethyl]triazole-4-carboxamide
CID 2134784
2-amino-6-fluoro-N-[[3-(3-methoxyphenoxy)phenyl]methyl]pyridine-3-carboxamide
CID 58104507
6-acetyl-N-[(3-methoxyphenyl)methyl]-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepine-2-carboxamide
CID 97442469
4-amino-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
CID 81242597
3-hydroxy-N-[(3-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 27231686
2-amino-N-[[3-[(3-methoxyphenyl)methoxy]phenyl]methyl]pyridine-3-carboxamide
CID 58104552

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The IUPAC name of 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide (CID 92620984) is 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide is COc1cccc(CNC(=O)c2cc3c(nc2N)CCN(Cc2cccc(C)c2OC)C3)c1.
What is the InChIKey of 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
The InChIKey is YLGAFGXJYCSPBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4O3/c1-17-6-4-8-19(24(17)33-3)15-30-11-10-23-20(16-30)13-22(25(27)29-23)26(31)28-14-18-7-5-9-21(12-18)32-2/h4-9,12-13H,10-11,14-16H2,1-3H3,(H2,27,29)(H,28,31).
What are the key properties of 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide?
2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide has a molecular weight of 446.55 g/mol, XLogP of 3.48, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[(2-methoxy-3-methylphenyl)methyl]-N-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 92620984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).