5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide

C20H25N3O2S — CID 71093531

IUPAC5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
SMILESCc1cnc(C(C)(C)NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)s1
InChIInChI=1S/C20H25N3O2S/c1-12-10-21-19(26-12)20(2,3)23-17(24)16-9-8-15(14-6-7-14)18(22-16)25-11-13-4-5-13/h8-10,13-14H,4-7,11H2,1-3H3,(H,23,24)
InChIKeyGJKSYGTYEWQMJR-UHFFFAOYSA-N
MW371.51 g/mol
LogP4.18
Rot. Bonds7

About 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide

5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide (PubChem CID 71093531) has the molecular formula C20H25N3O2S and a molecular weight of 371.51 g/mol. Its IUPAC name is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
PubChem CID71093531
Molecular FormulaC20H25N3O2S
Molecular Weight371.51 g/mol
Exact Mass371.17
IUPAC Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide
SMILESCc1cnc(C(C)(C)NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)s1
InChIInChI=1S/C20H25N3O2S/c1-12-10-21-19(26-12)20(2,3)23-17(24)16-9-8-15(14-6-7-14)18(22-16)25-11-13-4-5-13/h8-10,13-14H,4-7,11H2,1-3H3,(H,23,24)
InChIKeyGJKSYGTYEWQMJR-UHFFFAOYSA-N
XLogP4.18
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.51
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide (CID 71093531) is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide is Cc1cnc(C(C)(C)NC(=O)c2ccc(C3CC3)c(OCC3CC3)n2)s1.
What is the InChIKey of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
The InChIKey is GJKSYGTYEWQMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2S/c1-12-10-21-19(26-12)20(2,3)23-17(24)16-9-8-15(14-6-7-14)18(22-16)25-11-13-4-5-13/h8-10,13-14H,4-7,11H2,1-3H3,(H,23,24).
What are the key properties of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide?
5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide has a molecular weight of 371.51 g/mol, XLogP of 4.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 71093531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).