1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide

C19H29N3O2S — CID 72911822

IUPAC1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide
SMILESCc1csc(C(C)N(C)C(=O)C2CCN(C(=O)C3CCCC3)CC2)n1
InChIInChI=1S/C19H29N3O2S/c1-13-12-25-17(20-13)14(2)21(3)18(23)16-8-10-22(11-9-16)19(24)15-6-4-5-7-15/h12,14-16H,4-11H2,1-3H3
InChIKeyBZOZRQZDTICYSX-UHFFFAOYSA-N
MW363.53 g/mol
LogP3.40
Rot. Bonds4

About 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide

1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide (PubChem CID 72911822) has the molecular formula C19H29N3O2S and a molecular weight of 363.53 g/mol. Its IUPAC name is 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide
PubChem CID72911822
Molecular FormulaC19H29N3O2S
Molecular Weight363.53 g/mol
Exact Mass363.20
IUPAC Name1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide
SMILESCc1csc(C(C)N(C)C(=O)C2CCN(C(=O)C3CCCC3)CC2)n1
InChIInChI=1S/C19H29N3O2S/c1-13-12-25-17(20-13)14(2)21(3)18(23)16-8-10-22(11-9-16)19(24)15-6-4-5-7-15/h12,14-16H,4-11H2,1-3H3
InChIKeyBZOZRQZDTICYSX-UHFFFAOYSA-N
XLogP3.40
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.53
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-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 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide (CID 72911822) is 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide is Cc1csc(C(C)N(C)C(=O)C2CCN(C(=O)C3CCCC3)CC2)n1.
What is the InChIKey of 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is BZOZRQZDTICYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2S/c1-13-12-25-17(20-13)14(2)21(3)18(23)16-8-10-22(11-9-16)19(24)15-6-4-5-7-15/h12,14-16H,4-11H2,1-3H3.
What are the key properties of 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide?
1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 363.53 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonyl)-N-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 72911822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).