N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide

C11H22N2OS — CID 115672953

IUPACN-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide
SMILESCSC(C)(C)CNC(C)C(=O)NC1CC1
InChIInChI=1S/C11H22N2OS/c1-8(10(14)13-9-5-6-9)12-7-11(2,3)15-4/h8-9,12H,5-7H2,1-4H3,(H,13,14)
InChIKeyZKLVJKCMQXHFOT-UHFFFAOYSA-N
MW230.38 g/mol
LogP1.38
Rot. Bonds6

About N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide

N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide (PubChem CID 115672953) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide
PubChem CID115672953
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC NameN-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide
SMILESCSC(C)(C)CNC(C)C(=O)NC1CC1
InChIInChI=1S/C11H22N2OS/c1-8(10(14)13-9-5-6-9)12-7-11(2,3)15-4/h8-9,12H,5-7H2,1-4H3,(H,13,14)
InChIKeyZKLVJKCMQXHFOT-UHFFFAOYSA-N
XLogP1.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-(2,2-dimethylpropylamino)propanamide
CID 61168818
N-cyclopropyl-2-[(2-hydroxy-2-methylpentyl)amino]propanamide
CID 106293038
N-(1-cyclopentylethyl)-2-methyl-2-methylsulfanylpropan-1-amine
CID 115726039
N-cyclohexyl-2-[(3-hydroxy-2,2-dimethylpropyl)amino]propanamide
CID 113293835
2-(but-2-ynylamino)-N-cyclopropylpropanamide
CID 115865749
N-cyclopropyl-2-[(4-hydroxycyclohexyl)methylamino]propanamide
CID 114147898
N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394773
N-cyclopentyl-2-(cyclopropylmethylamino)propanamide
CID 43116561
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
N-cyclopropyl-2-(3-fluoropropylamino)propanamide
CID 115731798
N-cyclopropyl-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724718
N-cyclopropyl-2-[(2-hydroxycyclohexyl)methylamino]propanamide
CID 64913669

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide (CID 115672953) is N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide is CSC(C)(C)CNC(C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide?
The InChIKey is ZKLVJKCMQXHFOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2OS/c1-8(10(14)13-9-5-6-9)12-7-11(2,3)15-4/h8-9,12H,5-7H2,1-4H3,(H,13,14).
What are the key properties of N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide?
N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide has a molecular weight of 230.38 g/mol, XLogP of 1.38, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(2-methyl-2-methylsulfanylpropyl)amino]propanamide is sourced from PubChem (CID 115672953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).