2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide

C19H18N8OS — CID 138507426

IUPAC2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide
SMILESCC(C)n1nnnc1-c1cccc(NC(=O)c2cc3sc(C4CC4)nc3cn2)n1
InChIInChI=1S/C19H18N8OS/c1-10(2)27-17(24-25-26-27)12-4-3-5-16(21-12)23-18(28)13-8-15-14(9-20-13)22-19(29-15)11-6-7-11/h3-5,8-11H,6-7H2,1-2H3,(H,21,23,28)
InChIKeyTWANVWARJYSIJH-UHFFFAOYSA-N
MW406.48 g/mol
LogP3.45
Rot. Bonds5

About 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide

2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide (PubChem CID 138507426) has the molecular formula C19H18N8OS and a molecular weight of 406.48 g/mol. Its IUPAC name is 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide
PubChem CID138507426
Molecular FormulaC19H18N8OS
Molecular Weight406.48 g/mol
Exact Mass406.13
IUPAC Name2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide
SMILESCC(C)n1nnnc1-c1cccc(NC(=O)c2cc3sc(C4CC4)nc3cn2)n1
InChIInChI=1S/C19H18N8OS/c1-10(2)27-17(24-25-26-27)12-4-3-5-16(21-12)23-18(28)13-8-15-14(9-20-13)22-19(29-15)11-6-7-11/h3-5,8-11H,6-7H2,1-2H3,(H,21,23,28)
InChIKeyTWANVWARJYSIJH-UHFFFAOYSA-N
XLogP3.45
TPSA111.37 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

6-ethylsulfonyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
CID 157296522
N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-6-(2-methoxyethyl)-7,8-dihydro-5H-2,6-naphthyridine-3-carboxamide
CID 146199711
N-[6-[1-[(2R)-1-hydroxypropan-2-yl]tetrazol-5-yl]-2-pyridinyl]-5-methyl-4-pyridin-3-ylpyridine-2-carboxamide
CID 153183817
2-(butylamino)-5-fluoro-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-1,3-benzothiazole-6-carboxamide
CID 138507421
2-fluoro-4-methyl-5-(1-methylpyrazol-4-yl)-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]benzamide
CID 159186223
4-(4-cyclopropylimidazol-1-yl)-5-fluoro-N-[2-(1-propan-2-yltetrazol-5-yl)-1,3-thiazol-4-yl]pyridine-2-carboxamide
CID 140945206
4-[(5-cyclopropyl-2-pyridinyl)oxy]-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)-2-pyridinyl]pyridine-2-carboxamide
CID 135347895
4-(4-cyclopropylimidazol-1-yl)-5-(4-methylpiperidin-1-yl)-N-[2-(1-propan-2-yltetrazol-5-yl)-1,3-thiazol-4-yl]pyridine-2-carboxamide
CID 140945194
5-bromo-2-fluoro-4-methylbenzoic acid;5-(1-cyclopropylpyrazol-4-yl)-2-fluoro-4-methylbenzoic acid;bis(5-(1-cyclopropylpyrazol-4-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]benzamide)
CID 165005733
2-methoxy-4-methyl-5-(1-propan-2-ylpyrazol-3-yl)-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]benzamide
CID 153276703
5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-(hydroxymethyl)-N-[6-[1-(1-hydroxypropan-2-yl)tetrazol-5-yl]-2-pyridinyl]benzamide
CID 135376044
5-bromo-2-fluoro-4-methylbenzoic acid;(5-bromo-2-fluoro-4-methylphenyl)methanol;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]benzamide
CID 159722539

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide (CID 138507426) is 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide is CC(C)n1nnnc1-c1cccc(NC(=O)c2cc3sc(C4CC4)nc3cn2)n1.
What is the InChIKey of 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide?
The InChIKey is TWANVWARJYSIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N8OS/c1-10(2)27-17(24-25-26-27)12-4-3-5-16(21-12)23-18(28)13-8-15-14(9-20-13)22-19(29-15)11-6-7-11/h3-5,8-11H,6-7H2,1-2H3,(H,21,23,28).
What are the key properties of 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide?
2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide has a molecular weight of 406.48 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[6-(1-propan-2-yltetrazol-5-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-c]pyridine-6-carboxamide is sourced from PubChem (CID 138507426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).