N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane

C28H35N7O5 — CID 142284768

About N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane

N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane (PubChem CID 142284768) has the molecular formula C28H35N7O5 and a molecular weight of 549.63 g/mol. Its IUPAC name is N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane.

Molecular Properties

• Compound Name: N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane
• PubChem CID: 142284768
• Molecular Formula: C28H35N7O5
• Molecular Weight: 549.63 g/mol
• Exact Mass: 549.27
• IUPAC Name: N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane
• SMILES: CNc1cc(NC(=O)N2CCCc3cc(CN4CCC(OC)C4=O)c(C=O)nc32)ncc1C#N.COC1CCC1
• InChI: InChI=1S/C23H25N7O4.C5H10O/c1-25-17-9-20(26-11-16(17)10-24)28-23(33)30-6-3-4-14-8-15(18(13-31)27-21(14)30)12-29-7-5-19(34-2)22(29)32;1-6-5-3-2-4-5/h8-9,11,13,19H,3-7,12H2,1-2H3,(H2,25,26,28,33);5H,2-4H2,1H3
• InChIKey: FSXUFEAEKYCVAP-UHFFFAOYSA-N
• XLogP: 3.12
• TPSA: 149.78 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 7
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	549.63
LogP ≤ 5	3.12
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane?

The IUPAC name of N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane (CID 142284768) is N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane.

What is the SMILES notation for N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane?

The canonical SMILES for N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane is CNc1cc(NC(=O)N2CCCc3cc(CN4CCC(OC)C4=O)c(C=O)nc32)ncc1C#N.COC1CCC1.

What is the InChIKey of N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane?

The InChIKey is FSXUFEAEKYCVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O4.C5H10O/c1-25-17-9-20(26-11-16(17)10-24)28-23(33)30-6-3-4-14-8-15(18(13-31)27-21(14)30)12-29-7-5-19(34-2)22(29)32;1-6-5-3-2-4-5/h8-9,11,13,19H,3-7,12H2,1-2H3,(H2,25,26,28,33);5H,2-4H2,1H3.

What are the key properties of N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane?

N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane has a molecular weight of 549.63 g/mol, XLogP of 3.12, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-cyano-4-(methylamino)-2-pyridinyl]-7-formyl-6-[(3-methoxy-2-oxopyrrolidin-1-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;methoxycyclobutane is sourced from PubChem (CID 142284768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).