7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide

C19H17N5O2 — CID 167834981

IUPAC7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide
SMILESO=C1CCc2cc(C(=O)Nc3ccccc3Cn3cccn3)cnc2N1
InChIInChI=1S/C19H17N5O2/c25-17-7-6-13-10-15(11-20-18(13)23-17)19(26)22-16-5-2-1-4-14(16)12-24-9-3-8-21-24/h1-5,8-11H,6-7,12H2,(H,22,26)(H,20,23,25)
InChIKeyQCZIXBCJVCXNSZ-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.46
Rot. Bonds4

About 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide

7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide (PubChem CID 167834981) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide
PubChem CID167834981
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Name7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide
SMILESO=C1CCc2cc(C(=O)Nc3ccccc3Cn3cccn3)cnc2N1
InChIInChI=1S/C19H17N5O2/c25-17-7-6-13-10-15(11-20-18(13)23-17)19(26)22-16-5-2-1-4-14(16)12-24-9-3-8-21-24/h1-5,8-11H,6-7,12H2,(H,22,26)(H,20,23,25)
InChIKeyQCZIXBCJVCXNSZ-UHFFFAOYSA-N
XLogP2.46
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide (CID 167834981) is 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide is O=C1CCc2cc(C(=O)Nc3ccccc3Cn3cccn3)cnc2N1.
What is the InChIKey of 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide?
The InChIKey is QCZIXBCJVCXNSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c25-17-7-6-13-10-15(11-20-18(13)23-17)19(26)22-16-5-2-1-4-14(16)12-24-9-3-8-21-24/h1-5,8-11H,6-7,12H2,(H,22,26)(H,20,23,25).
What are the key properties of 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide?
7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide has a molecular weight of 347.38 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxo-N-[2-(pyrazol-1-ylmethyl)phenyl]-6,8-dihydro-5H-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 167834981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).