4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide

C13H25N3OS — CID 103787245

IUPAC4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide
SMILESCCSC1CCC(NC2CCN(C(N)=O)CC2)C1
InChIInChI=1S/C13H25N3OS/c1-2-18-12-4-3-11(9-12)15-10-5-7-16(8-6-10)13(14)17/h10-12,15H,2-9H2,1H3,(H2,14,17)
InChIKeyYAUFAPJWHQGEFT-UHFFFAOYSA-N
MW271.43 g/mol
LogP1.79
Rot. Bonds4

About 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide

4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide (PubChem CID 103787245) has the molecular formula C13H25N3OS and a molecular weight of 271.43 g/mol. Its IUPAC name is 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide
PubChem CID103787245
Molecular FormulaC13H25N3OS
Molecular Weight271.43 g/mol
Exact Mass271.17
IUPAC Name4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide
SMILESCCSC1CCC(NC2CCN(C(N)=O)CC2)C1
InChIInChI=1S/C13H25N3OS/c1-2-18-12-4-3-11(9-12)15-10-5-7-16(8-6-10)13(14)17/h10-12,15H,2-9H2,1H3,(H2,14,17)
InChIKeyYAUFAPJWHQGEFT-UHFFFAOYSA-N
XLogP1.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.43
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxylate
CID 103926013
ethyl 4-[[(1R,3S)-3-ethylsulfanylcyclohexyl]amino]piperidine-1-carboxylate
CID 97056311
4-[(3-ethylcyclohexyl)amino]piperidine-1-carboxamide
CID 64742206
4-[(3-methoxycyclopentyl)amino]piperidine-1-carboxamide
CID 103081793
ethyl 4-[(1-carbamoylpiperidin-4-yl)amino]cyclohexane-1-carboxylate
CID 60933460
2-[(3-ethylsulfanylcyclopentyl)amino]butanamide
CID 103711403
4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide
CID 61462070
2-amino-N-(3-ethylsulfanylcyclopentyl)propanamide
CID 103797921
4-ethyl-N-(3-ethylsulfanylcyclopentyl)cycloheptan-1-amine
CID 114122927
4-(methylamino)piperidine-1-carboxamide
CID 43754889
4-[[1-(cyclopropanecarbonyl)piperidin-4-yl]amino]piperidine-1-carboxamide
CID 43791478
4-[(1-cyclopropylpiperidin-4-yl)amino]piperidine-1-carboxamide
CID 43791337

Frequently Asked Questions

What is the IUPAC name of 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide?
The IUPAC name of 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide (CID 103787245) is 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide is CCSC1CCC(NC2CCN(C(N)=O)CC2)C1.
What is the InChIKey of 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide?
The InChIKey is YAUFAPJWHQGEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3OS/c1-2-18-12-4-3-11(9-12)15-10-5-7-16(8-6-10)13(14)17/h10-12,15H,2-9H2,1H3,(H2,14,17).
What are the key properties of 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide?
4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide has a molecular weight of 271.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 103787245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).