1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide

C19H29N3O2S — CID 72933035

IUPAC1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide
SMILESCC(C)c1nc(CN(C)C(=O)C2CCC(=O)N(C3CCCC3)C2)cs1
InChIInChI=1S/C19H29N3O2S/c1-13(2)18-20-15(12-25-18)11-21(3)19(24)14-8-9-17(23)22(10-14)16-6-4-5-7-16/h12-14,16H,4-11H2,1-3H3
InChIKeyOYTQAVHASVQBNF-UHFFFAOYSA-N
MW363.53 g/mol
LogP3.41
Rot. Bonds5

About 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide

1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide (PubChem CID 72933035) has the molecular formula C19H29N3O2S and a molecular weight of 363.53 g/mol. Its IUPAC name is 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide
PubChem CID72933035
Molecular FormulaC19H29N3O2S
Molecular Weight363.53 g/mol
Exact Mass363.20
IUPAC Name1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide
SMILESCC(C)c1nc(CN(C)C(=O)C2CCC(=O)N(C3CCCC3)C2)cs1
InChIInChI=1S/C19H29N3O2S/c1-13(2)18-20-15(12-25-18)11-21(3)19(24)14-8-9-17(23)22(10-14)16-6-4-5-7-16/h12-14,16H,4-11H2,1-3H3
InChIKeyOYTQAVHASVQBNF-UHFFFAOYSA-N
XLogP3.41
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.53
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide (CID 72933035) is 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide is CC(C)c1nc(CN(C)C(=O)C2CCC(=O)N(C3CCCC3)C2)cs1.
What is the InChIKey of 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide?
The InChIKey is OYTQAVHASVQBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2S/c1-13(2)18-20-15(12-25-18)11-21(3)19(24)14-8-9-17(23)22(10-14)16-6-4-5-7-16/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide?
1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide has a molecular weight of 363.53 g/mol, XLogP of 3.41, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-methyl-6-oxo-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 72933035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).