2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine

C10H20N2S — CID 103595894

IUPAC2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine
SMILESCN1CCSCC1C(N)CC1CC1
InChIInChI=1S/C10H20N2S/c1-12-4-5-13-7-10(12)9(11)6-8-2-3-8/h8-10H,2-7,11H2,1H3
InChIKeyWVQDSJWQCILOLP-UHFFFAOYSA-N
MW200.35 g/mol
LogP1.16
Rot. Bonds3

About 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine

2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine (PubChem CID 103595894) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine
PubChem CID103595894
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine
SMILESCN1CCSCC1C(N)CC1CC1
InChIInChI=1S/C10H20N2S/c1-12-4-5-13-7-10(12)9(11)6-8-2-3-8/h8-10H,2-7,11H2,1H3
InChIKeyWVQDSJWQCILOLP-UHFFFAOYSA-N
XLogP1.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 66993394
1-(4-Methyl-piperidin-1-ylmethyl)-3-methylsulfanyl-propylamine
CID 69831404
4-Methyl-3-(4-methylpiperidin-2-yl)thiomorpholine
CID 123673293
5-Methylpiperidin-3-amine;thiolane
CID 153331161
(1S)-1-[(2R)-3-ethyl-2-methylthiiran-2-yl]-N-(2-piperidin-1-ylethyl)ethanamine
CID 173792637
(2S)-1-(4-methylpiperidin-1-yl)-4-methylsulfanylbutan-2-amine
CID 22689697
2-Propyl-2-thiomorpholin-4-ylpentan-1-amine
CID 28787106
(2R,3R)-3-methyl-1-thiomorpholin-4-ylpentan-2-amine
CID 28787608
(2R,3S)-3-methyl-1-thiomorpholin-4-ylpentan-2-amine
CID 28787610
(2S,3R)-3-methyl-1-thiomorpholin-4-ylpentan-2-amine
CID 28787612
(2S,3S)-3-methyl-1-thiomorpholin-4-ylpentan-2-amine
CID 28787614
(2R)-4-methyl-1-thiomorpholin-4-ylpentan-2-amine
CID 28787627

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine (CID 103595894) is 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine is CN1CCSCC1C(N)CC1CC1.
What is the InChIKey of 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine?
The InChIKey is WVQDSJWQCILOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-12-4-5-13-7-10(12)9(11)6-8-2-3-8/h8-10H,2-7,11H2,1H3.
What are the key properties of 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine?
2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine has a molecular weight of 200.35 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(4-methylthiomorpholin-3-yl)ethanamine is sourced from PubChem (CID 103595894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).