2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide

C11H20N2OS — CID 63920663

IUPAC2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide
SMILESNC(=O)C(N)(CSC1CCCC1)C1CC1
InChIInChI=1S/C11H20N2OS/c12-10(14)11(13,8-5-6-8)7-15-9-3-1-2-4-9/h8-9H,1-7,13H2,(H2,12,14)
InChIKeyJHILZNISEYKTIW-UHFFFAOYSA-N
MW228.36 g/mol
LogP1.25
Rot. Bonds5

About 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide

2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide (PubChem CID 63920663) has the molecular formula C11H20N2OS and a molecular weight of 228.36 g/mol. Its IUPAC name is 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide.

Molecular Properties

Compound Name2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide
PubChem CID63920663
Molecular FormulaC11H20N2OS
Molecular Weight228.36 g/mol
Exact Mass228.13
IUPAC Name2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide
SMILESNC(=O)C(N)(CSC1CCCC1)C1CC1
InChIInChI=1S/C11H20N2OS/c12-10(14)11(13,8-5-6-8)7-15-9-3-1-2-4-9/h8-9H,1-7,13H2,(H2,12,14)
InChIKeyJHILZNISEYKTIW-UHFFFAOYSA-N
XLogP1.25
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-amino-3-cyclohexylsulfanyl-2-cyclopropylpropanoate
CID 63920634
2-amino-2-cyclopropyl-3-(oxan-4-ylsulfanyl)propanoic acid
CID 63919087
(2S)-2-amino-2-cyclohexylbutanamide
CID 67737232
3-cyclopentylsulfanyl-2-(ethylamino)-2-methylpropanamide
CID 63115926
2-amino-3-cyclohexyloxy-2-cyclopropylpropanamide
CID 63918796
2-amino-3-[cyclopentyl(methyl)amino]-2-cyclopropylpropanamide
CID 63910103
2-amino-2-cyclopropyl-3-(4-methylphenyl)sulfanylpropanamide
CID 63917847
ethyl 3-cyclohexylsulfanyl-2-cyclopropyl-2-(ethylamino)propanoate
CID 63920437
2-amino-2-cyclopropyl-3-(4-piperidin-1-ylpiperidin-1-yl)propanamide
CID 63909753
ethyl 3-cyclohexylsulfanyl-2-cyclopropyl-2-(cyclopropylamino)propanoate
CID 63920831
2,2,2-trifluoroethylsulfanylcyclopentane
CID 130682708
2-amino-2-cyclopropyl-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanamide
CID 63920649

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide?
The IUPAC name of 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide (CID 63920663) is 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide.
What is the SMILES notation for 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide?
The canonical SMILES for 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide is NC(=O)C(N)(CSC1CCCC1)C1CC1.
What is the InChIKey of 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide?
The InChIKey is JHILZNISEYKTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2OS/c12-10(14)11(13,8-5-6-8)7-15-9-3-1-2-4-9/h8-9H,1-7,13H2,(H2,12,14).
What are the key properties of 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide?
2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide has a molecular weight of 228.36 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-cyclopentylsulfanyl-2-cyclopropylpropanamide is sourced from PubChem (CID 63920663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).