4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide

C23H23FN4O3 — CID 118911019

IUPAC4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide
SMILESCOc1ccc(-c2cc(C(N)=O)nc3c2CCN(Cc2ccnc(OC)c2)C3)c(F)c1
InChIInChI=1S/C23H23FN4O3/c1-30-15-3-4-16(19(24)10-15)18-11-20(23(25)29)27-21-13-28(8-6-17(18)21)12-14-5-7-26-22(9-14)31-2/h3-5,7,9-11H,6,8,12-13H2,1-2H3,(H2,25,29)
InChIKeyHOCLVUXPXGNNBF-UHFFFAOYSA-N
MW422.46 g/mol
LogP2.96
Rot. Bonds6

About 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide

4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide (PubChem CID 118911019) has the molecular formula C23H23FN4O3 and a molecular weight of 422.46 g/mol. Its IUPAC name is 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide
PubChem CID118911019
Molecular FormulaC23H23FN4O3
Molecular Weight422.46 g/mol
Exact Mass422.18
IUPAC Name4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide
SMILESCOc1ccc(-c2cc(C(N)=O)nc3c2CCN(Cc2ccnc(OC)c2)C3)c(F)c1
InChIInChI=1S/C23H23FN4O3/c1-30-15-3-4-16(19(24)10-15)18-11-20(23(25)29)27-21-13-28(8-6-17(18)21)12-14-5-7-26-22(9-14)31-2/h3-5,7,9-11H,6,8,12-13H2,1-2H3,(H2,25,29)
InChIKeyHOCLVUXPXGNNBF-UHFFFAOYSA-N
XLogP2.96
TPSA90.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.46
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide?
The IUPAC name of 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide (CID 118911019) is 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide.
What is the SMILES notation for 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide?
The canonical SMILES for 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide is COc1ccc(-c2cc(C(N)=O)nc3c2CCN(Cc2ccnc(OC)c2)C3)c(F)c1.
What is the InChIKey of 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide?
The InChIKey is HOCLVUXPXGNNBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN4O3/c1-30-15-3-4-16(19(24)10-15)18-11-20(23(25)29)27-21-13-28(8-6-17(18)21)12-14-5-7-26-22(9-14)31-2/h3-5,7,9-11H,6,8,12-13H2,1-2H3,(H2,25,29).
What are the key properties of 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide?
4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide has a molecular weight of 422.46 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4-methoxyphenyl)-7-[(2-methoxy-4-pyridinyl)methyl]-6,8-dihydro-5H-1,7-naphthyridine-2-carboxamide is sourced from PubChem (CID 118911019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).