N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C19H17N5O2 — CID 118036904

IUPACN-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1ccc(NC(=O)N2CCCc3cc(C4CC4)c(C=O)nc32)nc1
InChIInChI=1S/C19H17N5O2/c20-9-12-3-6-17(21-10-12)23-19(26)24-7-1-2-14-8-15(13-4-5-13)16(11-25)22-18(14)24/h3,6,8,10-11,13H,1-2,4-5,7H2,(H,21,23,26)
InChIKeyIPZPDDMTAVNRHG-UHFFFAOYSA-N
MW347.38 g/mol
LogP3.02
Rot. Bonds3

About N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 118036904) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID118036904
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC NameN-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESN#Cc1ccc(NC(=O)N2CCCc3cc(C4CC4)c(C=O)nc32)nc1
InChIInChI=1S/C19H17N5O2/c20-9-12-3-6-17(21-10-12)23-19(26)24-7-1-2-14-8-15(13-4-5-13)16(11-25)22-18(14)24/h3,6,8,10-11,13H,1-2,4-5,7H2,(H,21,23,26)
InChIKeyIPZPDDMTAVNRHG-UHFFFAOYSA-N
XLogP3.02
TPSA98.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 118036904) is N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is N#Cc1ccc(NC(=O)N2CCCc3cc(C4CC4)c(C=O)nc32)nc1.
What is the InChIKey of N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is IPZPDDMTAVNRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c20-9-12-3-6-17(21-10-12)23-19(26)24-7-1-2-14-8-15(13-4-5-13)16(11-25)22-18(14)24/h3,6,8,10-11,13H,1-2,4-5,7H2,(H,21,23,26).
What are the key properties of N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 347.38 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2-pyridinyl)-6-cyclopropyl-7-formyl-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 118036904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).