(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide

C10H18N2OS — CID 140571166

IUPAC(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide
SMILESCC(C)(C[C@@H](CC#N)C1CC1)S(N)=O
InChIInChI=1S/C10H18N2OS/c1-10(2,14(12)13)7-9(5-6-11)8-3-4-8/h8-9H,3-5,7,12H2,1-2H3/t9-,14?/m1/s1
InChIKeyLHUHDJBRUOZRPL-UCWRFOARSA-N
MW214.33 g/mol
LogP1.72
Rot. Bonds5

About (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide

(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide (PubChem CID 140571166) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide.

Molecular Properties

Compound Name(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide
PubChem CID140571166
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide
SMILESCC(C)(C[C@@H](CC#N)C1CC1)S(N)=O
InChIInChI=1S/C10H18N2OS/c1-10(2,14(12)13)7-9(5-6-11)8-3-4-8/h8-9H,3-5,7,12H2,1-2H3/t9-,14?/m1/s1
InChIKeyLHUHDJBRUOZRPL-UCWRFOARSA-N
XLogP1.72
TPSA66.88 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4R)-4-cyclopropyl-4-[(2S)-3,4-dihydro-2H-pyran-2-yl]-2-methylbutane-2-sulfinamide
CID 166506868
3-cyclopentylpentanenitrile;ethane
CID 155599188
(3R)-3-cyclopentylbutanenitrile
CID 142587124
2-cyclopropyl-N,4,4-trimethylpentan-1-amine
CID 83827155
3-cyclohexyl-4-fluoro-4-methylpentanenitrile
CID 105450999
3-cycloheptyl-4-methylpentanenitrile
CID 67965057
3-cyclopropyl-4,4-difluorobutanenitrile
CID 105428729
3-amino-4,4-dimethylpentanenitrile
CID 87235044
3-cyclohexyl-2-methylbutane-2-sulfinamide
CID 89464801
3-amino-4,4-dimethylpentanenitrile;hydrochloride
CID 87235043
3-(oxolan-3-yl)hexanenitrile
CID 142587151
2-amino-N-(1-cyanobutan-2-yl)-2-cyclopropylpropanamide
CID 62646915

Frequently Asked Questions

What is the IUPAC name of (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide?
The IUPAC name of (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide (CID 140571166) is (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide.
What is the SMILES notation for (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide?
The canonical SMILES for (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide is CC(C)(C[C@@H](CC#N)C1CC1)S(N)=O.
What is the InChIKey of (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide?
The InChIKey is LHUHDJBRUOZRPL-UCWRFOARSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-10(2,14(12)13)7-9(5-6-11)8-3-4-8/h8-9H,3-5,7,12H2,1-2H3/t9-,14?/m1/s1.
What are the key properties of (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide?
(4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide has a molecular weight of 214.33 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-5-cyano-4-cyclopropyl-2-methylpentane-2-sulfinamide is sourced from PubChem (CID 140571166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).