2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide

C14H14N4O2S — CID 141452975

IUPAC2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide
SMILESCc1ncc(NC(=O)c2ccnc(C(=O)NC3CC3)c2)s1
InChIInChI=1S/C14H14N4O2S/c1-8-16-7-12(21-8)18-13(19)9-4-5-15-11(6-9)14(20)17-10-2-3-10/h4-7,10H,2-3H2,1H3,(H,17,20)(H,18,19)
InChIKeyGVVXRNAXDBMSRJ-UHFFFAOYSA-N
MW302.36 g/mol
LogP1.99
Rot. Bonds4

About 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide

2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide (PubChem CID 141452975) has the molecular formula C14H14N4O2S and a molecular weight of 302.36 g/mol. Its IUPAC name is 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide
PubChem CID141452975
Molecular FormulaC14H14N4O2S
Molecular Weight302.36 g/mol
Exact Mass302.08
IUPAC Name2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide
SMILESCc1ncc(NC(=O)c2ccnc(C(=O)NC3CC3)c2)s1
InChIInChI=1S/C14H14N4O2S/c1-8-16-7-12(21-8)18-13(19)9-4-5-15-11(6-9)14(20)17-10-2-3-10/h4-7,10H,2-3H2,1H3,(H,17,20)(H,18,19)
InChIKeyGVVXRNAXDBMSRJ-UHFFFAOYSA-N
XLogP1.99
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide (CID 141452975) is 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide is Cc1ncc(NC(=O)c2ccnc(C(=O)NC3CC3)c2)s1.
What is the InChIKey of 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide?
The InChIKey is GVVXRNAXDBMSRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2S/c1-8-16-7-12(21-8)18-13(19)9-4-5-15-11(6-9)14(20)17-10-2-3-10/h4-7,10H,2-3H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide?
2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide has a molecular weight of 302.36 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 141452975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).