N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide

C15H25N3OS — CID 53016871

IUPACN-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C15H25N3OS/c1-10(2)13-9-20-14(17-13)12-5-7-18(8-6-12)15(19)16-11(3)4/h9-12H,5-8H2,1-4H3,(H,16,19)
InChIKeyUCUHJGAMVVOQSR-UHFFFAOYSA-N
MW295.45 g/mol
LogP3.56
Rot. Bonds3

About N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide

N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide (PubChem CID 53016871) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
PubChem CID53016871
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC NameN-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C15H25N3OS/c1-10(2)13-9-20-14(17-13)12-5-7-18(8-6-12)15(19)16-11(3)4/h9-12H,5-8H2,1-4H3,(H,16,19)
InChIKeyUCUHJGAMVVOQSR-UHFFFAOYSA-N
XLogP3.56
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide (CID 53016871) is N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide is CC(C)NC(=O)N1CCC(c2nc(C(C)C)cs2)CC1.
What is the InChIKey of N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is UCUHJGAMVVOQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-10(2)13-9-20-14(17-13)12-5-7-18(8-6-12)15(19)16-11(3)4/h9-12H,5-8H2,1-4H3,(H,16,19).
What are the key properties of N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 295.45 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 53016871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).