1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine

C13H26N2S — CID 115722032

IUPAC1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine
SMILESCSCCC(C)NC1CC(C)N(C2CC2)C1
InChIInChI=1S/C13H26N2S/c1-10(6-7-16-3)14-12-8-11(2)15(9-12)13-4-5-13/h10-14H,4-9H2,1-3H3
InChIKeyUUVQMTQVNKOYCF-UHFFFAOYSA-N
MW242.43 g/mol
LogP2.34
Rot. Bonds6

About 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine

1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine (PubChem CID 115722032) has the molecular formula C13H26N2S and a molecular weight of 242.43 g/mol. Its IUPAC name is 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine
PubChem CID115722032
Molecular FormulaC13H26N2S
Molecular Weight242.43 g/mol
Exact Mass242.18
IUPAC Name1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine
SMILESCSCCC(C)NC1CC(C)N(C2CC2)C1
InChIInChI=1S/C13H26N2S/c1-10(6-7-16-3)14-12-8-11(2)15(9-12)13-4-5-13/h10-14H,4-9H2,1-3H3
InChIKeyUUVQMTQVNKOYCF-UHFFFAOYSA-N
XLogP2.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine 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

N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115705721
(2S)-2-[(1-cyclopropyl-5-methylpyrrolidin-3-yl)amino]propan-1-ol
CID 103789093
1-cyclopropyl-N-(1-cyclopropylpropan-2-yl)-5-methylpyrrolidin-3-amine
CID 115719729
(2S)-2-amino-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-4-methylsulfanylbutanamide
CID 119900300
1-cyclopropyl-N-(3,3-dimethylbutan-2-yl)-5-methylpyrrolidin-3-amine
CID 115719166
1-cyclopropyl-5-methyl-N-[1-(2-methylphenyl)propan-2-yl]pyrrolidin-3-amine
CID 115713788
1-cyclopropyl-5-methyl-N-[1-(5-methylthiophen-2-yl)propan-2-yl]pyrrolidin-3-amine
CID 115722163
methyl (2S)-2-[(1-cyclopropyl-5-methylpyrrolidin-3-yl)amino]propanoate
CID 104866700
N-[1-(3-chlorophenyl)propan-2-yl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115713569
3-methoxy-N-(4-methylsulfanylbutan-2-yl)cyclobutan-1-amine
CID 104871600
1-[4-(4-methylsulfanylbutan-2-ylamino)piperidin-1-yl]ethanone
CID 115639941
1-cyclopropyl-5-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]pyrrolidin-3-amine
CID 104866703

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine?
The IUPAC name of 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine (CID 115722032) is 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine?
The canonical SMILES for 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine is CSCCC(C)NC1CC(C)N(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine?
The InChIKey is UUVQMTQVNKOYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2S/c1-10(6-7-16-3)14-12-8-11(2)15(9-12)13-4-5-13/h10-14H,4-9H2,1-3H3.
What are the key properties of 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine?
1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine has a molecular weight of 242.43 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-methyl-N-(4-methylsulfanylbutan-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 115722032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).