(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane

C12H26N2S — CID 157436749

IUPAC(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane
SMILESN[C@H](CN1CCCC1)C1CCCCC1.S
InChIInChI=1S/C12H24N2.H2S/c13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;/h11-12H,1-10,13H2;1H2/t12-;/m1./s1
InChIKeyBREUSPWRRFNAMA-UTONKHPSSA-N
MW230.42 g/mol
LogP2.10
Rot. Bonds3

About (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane

(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane (PubChem CID 157436749) has the molecular formula C12H26N2S and a molecular weight of 230.42 g/mol. Its IUPAC name is (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane.

Molecular Properties

Compound Name(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane
PubChem CID157436749
Molecular FormulaC12H26N2S
Molecular Weight230.42 g/mol
Exact Mass230.18
IUPAC Name(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane
SMILESN[C@H](CN1CCCC1)C1CCCCC1.S
InChIInChI=1S/C12H24N2.H2S/c13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;/h11-12H,1-10,13H2;1H2/t12-;/m1./s1
InChIKeyBREUSPWRRFNAMA-UTONKHPSSA-N
XLogP2.10
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane 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

2-Cyclohexylpyrrolidine
CID 4637746
2-(Cyclohexylmethyl)pyrrolidine
CID 4442674
(2-Amino-1-cyclohexylethyl)dimethylamine
CID 16228005
1-[(Pyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 3159681
1-Methyl-1-azaspiro[4.5]decan-4-amine
CID 13282860
[(2S)-2-amino-2-cyclohexylethyl]dimethylamine
CID 58598201
2-[2-(Propan-2-yl)pyrrolidin-1-yl]ethan-1-amine
CID 65713052
(Cyclohexylmethyl)[2-(pyrrolidin-1-yl)ethyl]amine dihydrochloride
CID 154808043
1-[1-(1-Pyrrolidinyl)cyclohexyl]methanamine
CID 7825865
2-Cyclohexyl-2-pyrrolidin-1-ylethanamine
CID 16792616
1-Cyclohexyl-2-pyrrolidin-1-ylethanamine
CID 77589306
(S)-2-Cyclohexylpyrrolidine
CID 51385317

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane?
The IUPAC name of (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane (CID 157436749) is (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane.
What is the SMILES notation for (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane?
The canonical SMILES for (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane is N[C@H](CN1CCCC1)C1CCCCC1.S.
What is the InChIKey of (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane?
The InChIKey is BREUSPWRRFNAMA-UTONKHPSSA-N. The full InChI is InChI=1S/C12H24N2.H2S/c13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;/h11-12H,1-10,13H2;1H2/t12-;/m1./s1.
What are the key properties of (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane?
(1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane has a molecular weight of 230.42 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclohexyl-2-pyrrolidin-1-ylethanamine;sulfane is sourced from PubChem (CID 157436749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).