N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C75H87F3N18O15 — CID 157311779

About N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 157311779) has the molecular formula C75H87F3N18O15 and a molecular weight of 1537.63 g/mol. Its IUPAC name is N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

• Compound Name: N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
• PubChem CID: 157311779
• Molecular Formula: C75H87F3N18O15
• Molecular Weight: 1537.63 g/mol
• Exact Mass: 1536.66
• IUPAC Name: N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
• SMILES: COC(OC)c1nc2c(cc1CN(C)C(=O)C1CCOC1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1.COC(OC)c1nc2c(cc1CN(C)C(=O)[C@@H]1CCCO1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1.COC(OC)c1nc2c(cc1CN(C)C(=O)[C@H]1CCCO1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1
• InChI: InChI=1S/3C25H29FN6O5/c2*1-31(23(33)19-7-5-9-37-19)14-16-10-15-6-4-8-32(22(15)30-21(16)24(35-2)36-3)25(34)29-20-11-18(26)17(12-27)13-28-20;1-31(23(33)16-6-8-37-14-16)13-17-9-15-5-4-7-32(22(15)30-21(17)24(35-2)36-3)25(34)29-20-10-19(26)18(11-27)12-28-20/h2*10-11,13,19,24H,4-9,14H2,1-3H3,(H,28,29,34);9-10,12,16,24H,4-8,13-14H2,1-3H3,(H,28,29,34)/t2*19-;/m10./s1
• InChIKey: BDCVZLLXZSFENP-CSBSUJFHSA-N
• XLogP: 8.56
• TPSA: 389.73 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 24
• Rotatable Bonds: 21
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1537.63
LogP ≤ 5	8.56
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?

The IUPAC name of N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 157311779) is N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

What is the SMILES notation for N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?

The canonical SMILES for N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is COC(OC)c1nc2c(cc1CN(C)C(=O)C1CCOC1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1.COC(OC)c1nc2c(cc1CN(C)C(=O)[C@@H]1CCCO1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1.COC(OC)c1nc2c(cc1CN(C)C(=O)[C@H]1CCCO1)CCCN2C(=O)Nc1cc(F)c(C#N)cn1.

What is the InChIKey of N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?

The InChIKey is BDCVZLLXZSFENP-CSBSUJFHSA-N. The full InChI is InChI=1S/3C25H29FN6O5/c2*1-31(23(33)19-7-5-9-37-19)14-16-10-15-6-4-8-32(22(15)30-21(16)24(35-2)36-3)25(34)29-20-11-18(26)17(12-27)13-28-20;1-31(23(33)16-6-8-37-14-16)13-17-9-15-5-4-7-32(22(15)30-21(17)24(35-2)36-3)25(34)29-20-10-19(26)18(11-27)12-28-20/h2*10-11,13,19,24H,4-9,14H2,1-3H3,(H,28,29,34);9-10,12,16,24H,4-8,13-14H2,1-3H3,(H,28,29,34)/t2*19-;/m10./s1.

What are the key properties of N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?

N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 1537.63 g/mol, XLogP of 8.56, 21 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2S)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl-[(2R)-oxolane-2-carbonyl]amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;N-(5-cyano-4-fluoro-2-pyridinyl)-7-(dimethoxymethyl)-6-[[methyl(oxolane-3-carbonyl)amino]methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 157311779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).