N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide

C19H15FN4O3 — CID 90929305

IUPACN-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide
SMILESCOc1ccc2ncc3[nH]cc(C(=O)Nc4ccc(OC)c(F)c4)c3c2n1
InChIInChI=1S/C19H15FN4O3/c1-26-15-5-3-10(7-12(15)20)23-19(25)11-8-21-14-9-22-13-4-6-16(27-2)24-18(13)17(11)14/h3-9,21H,1-2H3,(H,23,25)
InChIKeyDVGJCCHVNFJXEM-UHFFFAOYSA-N
MW366.35 g/mol
LogP3.52
Rot. Bonds4

About N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide

N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide (PubChem CID 90929305) has the molecular formula C19H15FN4O3 and a molecular weight of 366.35 g/mol. Its IUPAC name is N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide
PubChem CID90929305
Molecular FormulaC19H15FN4O3
Molecular Weight366.35 g/mol
Exact Mass366.11
IUPAC NameN-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide
SMILESCOc1ccc2ncc3[nH]cc(C(=O)Nc4ccc(OC)c(F)c4)c3c2n1
InChIInChI=1S/C19H15FN4O3/c1-26-15-5-3-10(7-12(15)20)23-19(25)11-8-21-14-9-22-13-4-6-16(27-2)24-18(13)17(11)14/h3-9,21H,1-2H3,(H,23,25)
InChIKeyDVGJCCHVNFJXEM-UHFFFAOYSA-N
XLogP3.52
TPSA89.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.35
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide?
The IUPAC name of N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide (CID 90929305) is N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide?
The canonical SMILES for N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide is COc1ccc2ncc3[nH]cc(C(=O)Nc4ccc(OC)c(F)c4)c3c2n1.
What is the InChIKey of N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide?
The InChIKey is DVGJCCHVNFJXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O3/c1-26-15-5-3-10(7-12(15)20)23-19(25)11-8-21-14-9-22-13-4-6-16(27-2)24-18(13)17(11)14/h3-9,21H,1-2H3,(H,23,25).
What are the key properties of N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide?
N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide has a molecular weight of 366.35 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methoxyphenyl)-2-methoxy-7H-pyrrolo[2,3-c][1,5]naphthyridine-9-carboxamide is sourced from PubChem (CID 90929305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).