4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide

C10H16N4OS — CID 61283472

IUPAC4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2nccs2)CC1
InChIInChI=1S/C10H16N4OS/c11-10(15)14-4-1-8(2-5-14)13-7-9-12-3-6-16-9/h3,6,8,13H,1-2,4-5,7H2,(H2,11,15)
InChIKeyOTAJBYIRTONYMV-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.78
Rot. Bonds3

About 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide

4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide (PubChem CID 61283472) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide
PubChem CID61283472
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC Name4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(NCc2nccs2)CC1
InChIInChI=1S/C10H16N4OS/c11-10(15)14-4-1-8(2-5-14)13-7-9-12-3-6-16-9/h3,6,8,13H,1-2,4-5,7H2,(H2,11,15)
InChIKeyOTAJBYIRTONYMV-UHFFFAOYSA-N
XLogP0.78
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(1,3-thiazol-2-yl)propylamino]piperidine-1-carboxamide
CID 104584924
1-tert-butyl-N-(1,3-thiazol-2-ylmethyl)piperidin-4-amine
CID 63001484
4-(pyridin-4-ylmethylamino)piperidine-1-carboxamide
CID 43769393
4-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]piperidine-1-carboxamide
CID 71975057
1-ethyl-N-(1,3-thiazol-2-ylmethyl)azepan-4-amine
CID 65073772
4-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
CID 58902693
1-propan-2-yl-N-(1,3-thiazol-2-ylmethyl)azepan-4-amine
CID 65073726
4-(benzylamino)piperidine-1-carboxamide
CID 43757030
3-N-(1,3-thiazol-2-ylmethyl)cyclopentane-1,3-diamine
CID 79462024
tert-butyl 5-(1,3-thiazol-2-ylmethylamino)-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxylate
CID 126818908
4-[(2-amino-2-oxoethyl)amino]piperidine-1-carboxamide
CID 43754739
1-benzyl-N-(1,3-thiazol-2-ylmethyl)pyrrolidin-3-amine
CID 61285826

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide?
The IUPAC name of 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide (CID 61283472) is 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide.
What is the SMILES notation for 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide?
The canonical SMILES for 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide is NC(=O)N1CCC(NCc2nccs2)CC1.
What is the InChIKey of 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide?
The InChIKey is OTAJBYIRTONYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c11-10(15)14-4-1-8(2-5-14)13-7-9-12-3-6-16-9/h3,6,8,13H,1-2,4-5,7H2,(H2,11,15).
What are the key properties of 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide?
4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-thiazol-2-ylmethylamino)piperidine-1-carboxamide is sourced from PubChem (CID 61283472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).