1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

C18H19N5OS — CID 168925803

IUPAC1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESCN1CCC(C(=O)Nc2ncc(-c3cnc4cnccc4c3)s2)CC1
InChIInChI=1S/C18H19N5OS/c1-23-6-3-12(4-7-23)17(24)22-18-21-11-16(25-18)14-8-13-2-5-19-10-15(13)20-9-14/h2,5,8-12H,3-4,6-7H2,1H3,(H,21,22,24)
InChIKeyDRWGVKIXPOCDAN-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.03
Rot. Bonds3

About 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (PubChem CID 168925803) has the molecular formula C18H19N5OS and a molecular weight of 353.45 g/mol. Its IUPAC name is 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
PubChem CID168925803
Molecular FormulaC18H19N5OS
Molecular Weight353.45 g/mol
Exact Mass353.13
IUPAC Name1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESCN1CCC(C(=O)Nc2ncc(-c3cnc4cnccc4c3)s2)CC1
InChIInChI=1S/C18H19N5OS/c1-23-6-3-12(4-7-23)17(24)22-18-21-11-16(25-18)14-8-13-2-5-19-10-15(13)20-9-14/h2,5,8-12H,3-4,6-7H2,1H3,(H,21,22,24)
InChIKeyDRWGVKIXPOCDAN-UHFFFAOYSA-N
XLogP3.03
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-N-(5-phenyl-1,3-thiazol-2-yl)piperidine-4-carboxamide;molecular hydrogen
CID 178083926
N-(5-isoquinolin-6-yl-1,3-thiazol-2-yl)oxane-4-carboxamide
CID 168925799
1-cyclopropyl-N-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 167847958
1-methyl-N-[3-[6-(propan-2-ylamino)pyrazin-2-yl]-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
CID 138590247
N-(5-phenyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 10125249
N-[3-(5-methoxy-3-pyridinyl)-1,7-naphthyridin-6-yl]-1-methylpiperidine-4-carboxamide
CID 138586735
N-[3-(5-cyano-3-pyridinyl)-1,7-naphthyridin-6-yl]-1-methylpiperidine-4-carboxamide
CID 138589108
N-(5-isoquinolin-6-yl-1,3-thiazol-2-yl)quinoline-3-carboxamide
CID 168925353
(3S)-3-[(5-phenyl-1,3-thiazol-2-yl)carbamoyl]pyrrolidine-1-carboxylic acid
CID 118980355
N-[5-(3-fluorophenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 87405192
1-methyl-N-[6-(1,2-thiazol-4-yl)cinnolin-3-yl]piperidine-4-carboxamide
CID 138588116
N-[5-(3-chloroisoquinolin-6-yl)-1,3-thiazol-2-yl]-1,1-dioxothiane-4-carboxamide
CID 168925382

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (CID 168925803) is 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is CN1CCC(C(=O)Nc2ncc(-c3cnc4cnccc4c3)s2)CC1.
What is the InChIKey of 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The InChIKey is DRWGVKIXPOCDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5OS/c1-23-6-3-12(4-7-23)17(24)22-18-21-11-16(25-18)14-8-13-2-5-19-10-15(13)20-9-14/h2,5,8-12H,3-4,6-7H2,1H3,(H,21,22,24).
What are the key properties of 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide has a molecular weight of 353.45 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[5-(1,7-naphthyridin-3-yl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 168925803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).