N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide

C15H14N4O2S — CID 126788935

IUPACN,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide
SMILESCc1ccc2c(=O)c(C(=O)N(C)Cc3nccs3)c[nH]c2n1
InChIInChI=1S/C15H14N4O2S/c1-9-3-4-10-13(20)11(7-17-14(10)18-9)15(21)19(2)8-12-16-5-6-22-12/h3-7H,8H2,1-2H3,(H,17,18,20)
InChIKeyMPZZXCLTIXDTNT-UHFFFAOYSA-N
MW314.37 g/mol
LogP1.96
Rot. Bonds3

About N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide

N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide (PubChem CID 126788935) has the molecular formula C15H14N4O2S and a molecular weight of 314.37 g/mol. Its IUPAC name is N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide
PubChem CID126788935
Molecular FormulaC15H14N4O2S
Molecular Weight314.37 g/mol
Exact Mass314.08
IUPAC NameN,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide
SMILESCc1ccc2c(=O)c(C(=O)N(C)Cc3nccs3)c[nH]c2n1
InChIInChI=1S/C15H14N4O2S/c1-9-3-4-10-13(20)11(7-17-14(10)18-9)15(21)19(2)8-12-16-5-6-22-12/h3-7H,8H2,1-2H3,(H,17,18,20)
InChIKeyMPZZXCLTIXDTNT-UHFFFAOYSA-N
XLogP1.96
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(ethylamino)-2-oxoethyl]-7-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxamide
CID 87002233
2-fluoro-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 110715660
(3,5-dimethyl-1,2-thiazol-4-yl)methyl 7-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 167937880
7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide
CID 60506748
6-fluoro-N-(2-hydroxyethyl)-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-quinoline-3-carboxamide
CID 74237743
2-methoxy-N,6-dimethyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 131946527
N-(3-bromophenyl)-7-methyl-4-oxo-1H-1,8-naphthyridine-3-carboxamide
CID 112707523
6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol
CID 136519670
N-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 154858407
7-methyl-N-[2-(2-methylindol-1-yl)ethyl]-4-oxo-1H-1,8-naphthyridine-3-carboxamide
CID 126578263
N-methyl-N-(1,3-thiazol-2-ylmethyl)prop-2-ynamide
CID 130614901
ethyl 7-methyl-4-oxo-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-carboxylate
CID 91367850

Frequently Asked Questions

What is the IUPAC name of N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide (CID 126788935) is N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide is Cc1ccc2c(=O)c(C(=O)N(C)Cc3nccs3)c[nH]c2n1.
What is the InChIKey of N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide?
The InChIKey is MPZZXCLTIXDTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2S/c1-9-3-4-10-13(20)11(7-17-14(10)18-9)15(21)19(2)8-12-16-5-6-22-12/h3-7H,8H2,1-2H3,(H,17,18,20).
What are the key properties of N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide?
N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide has a molecular weight of 314.37 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 126788935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).