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

C25H30N10OS — CID 140945194

IUPAC4-(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
SMILESCC1CCN(c2cnc(C(=O)Nc3csc(-c4nnnn4C(C)C)n3)cc2-n2cnc(C3CC3)c2)CC1
InChIInChI=1S/C25H30N10OS/c1-15(2)35-23(30-31-32-35)25-29-22(13-37-25)28-24(36)18-10-20(34-12-19(27-14-34)17-4-5-17)21(11-26-18)33-8-6-16(3)7-9-33/h10-17H,4-9H2,1-3H3,(H,28,36)
InChIKeyYEARMHDKKLUQAZ-UHFFFAOYSA-N
MW518.65 g/mol
LogP4.32
Rot. Bonds7

About 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

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 (PubChem CID 140945194) has the molecular formula C25H30N10OS and a molecular weight of 518.65 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-(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
PubChem CID140945194
Molecular FormulaC25H30N10OS
Molecular Weight518.65 g/mol
Exact Mass518.23
IUPAC Name4-(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
SMILESCC1CCN(c2cnc(C(=O)Nc3csc(-c4nnnn4C(C)C)n3)cc2-n2cnc(C3CC3)c2)CC1
InChIInChI=1S/C25H30N10OS/c1-15(2)35-23(30-31-32-35)25-29-22(13-37-25)28-24(36)18-10-20(34-12-19(27-14-34)17-4-5-17)21(11-26-18)33-8-6-16(3)7-9-33/h10-17H,4-9H2,1-3H3,(H,28,36)
InChIKeyYEARMHDKKLUQAZ-UHFFFAOYSA-N
XLogP4.32
TPSA119.54 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.65
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze 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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1CCN(c2cnc(C(=O)Nc3csc(-c4nnnn4C(C)C)n3)cc2-n2cnc(C3CC3)c2)CC1.
What is the InChIKey of 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?
The InChIKey is YEARMHDKKLUQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N10OS/c1-15(2)35-23(30-31-32-35)25-29-22(13-37-25)28-24(36)18-10-20(34-12-19(27-14-34)17-4-5-17)21(11-26-18)33-8-6-16(3)7-9-33/h10-17H,4-9H2,1-3H3,(H,28,36).
What are the key properties of 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?
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 has a molecular weight of 518.65 g/mol, XLogP of 4.32, 7 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 140945194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).