N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine

C12H24N2OS — CID 66422757

IUPACN-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine
SMILESCOCCN(CCC1CSCCN1)C1CC1
InChIInChI=1S/C12H24N2OS/c1-15-8-7-14(12-2-3-12)6-4-11-10-16-9-5-13-11/h11-13H,2-10H2,1H3
InChIKeyPHLXJTNUTXPNNX-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.19
Rot. Bonds7

About N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine

N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine (PubChem CID 66422757) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine
PubChem CID66422757
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC NameN-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine
SMILESCOCCN(CCC1CSCCN1)C1CC1
InChIInChI=1S/C12H24N2OS/c1-15-8-7-14(12-2-3-12)6-4-11-10-16-9-5-13-11/h11-13H,2-10H2,1H3
InChIKeyPHLXJTNUTXPNNX-UHFFFAOYSA-N
XLogP1.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine
CID 66422522
N-(2-methoxyethyl)-2-methyl-N-(2-thiomorpholin-3-ylethyl)propan-1-amine
CID 66422368
N-(2-methoxyethyl)-2-thiomorpholin-3-ylethanamine
CID 66420350
N-(2-methoxyethyl)-N-(thiomorpholin-3-ylmethyl)prop-2-en-1-amine
CID 103339487
N-[2-(azetidin-3-yl)ethyl]-N-(2-methoxyethyl)cyclopropanamine
CID 116679681
N,N-bis(2-methoxyethyl)piperidin-4-amine
CID 61418821
4-ethyl-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106605809
N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-thiomorpholin-3-ylacetamide
CID 119941360
4-methoxy-N-methyl-N-(2-thiomorpholin-3-ylethyl)aniline
CID 66419959
5-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyrrolidin-3-ol
CID 66056161
N-(2-methoxyethyl)-N-(piperidin-3-ylmethyl)thian-3-amine;hydrochloride
CID 120858112
3-(thiomorpholin-3-ylmethyl)thiomorpholine
CID 68605296

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine?
The IUPAC name of N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine (CID 66422757) is N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine?
The canonical SMILES for N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine is COCCN(CCC1CSCCN1)C1CC1.
What is the InChIKey of N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine?
The InChIKey is PHLXJTNUTXPNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c1-15-8-7-14(12-2-3-12)6-4-11-10-16-9-5-13-11/h11-13H,2-10H2,1H3.
What are the key properties of N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine?
N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine has a molecular weight of 244.40 g/mol, XLogP of 1.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(2-thiomorpholin-3-ylethyl)cyclopropanamine is sourced from PubChem (CID 66422757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).