N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide

C11H22N2OS — CID 107132515

IUPACN-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide
SMILESCCN(C)C(=O)C(C)NCC1CCSC1
InChIInChI=1S/C11H22N2OS/c1-4-13(3)11(14)9(2)12-7-10-5-6-15-8-10/h9-10,12H,4-8H2,1-3H3
InChIKeyFCBOQWVQQYHSNA-UHFFFAOYSA-N
MW230.38 g/mol
LogP1.20
Rot. Bonds5

About N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide

N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide (PubChem CID 107132515) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide
PubChem CID107132515
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC NameN-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide
SMILESCCN(C)C(=O)C(C)NCC1CCSC1
InChIInChI=1S/C11H22N2OS/c1-4-13(3)11(14)9(2)12-7-10-5-6-15-8-10/h9-10,12H,4-8H2,1-3H3
InChIKeyFCBOQWVQQYHSNA-UHFFFAOYSA-N
XLogP1.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979
2-(cycloheptylmethylamino)-N-ethyl-N-methylpropanamide
CID 103107981
ethyl 2-(thiolan-3-ylmethylamino)propanoate
CID 107131969
1-ethyl-1-methyl-3-(thiolan-3-ylmethyl)urea
CID 107295561
2-[(4-tert-butylcyclohexyl)methylamino]-N-ethyl-N-methylpropanamide
CID 103107695
N-butyl-2-(thiolan-3-ylmethylamino)propanamide
CID 107295770
N-ethyl-N-methyl-2-(oxan-3-ylmethylamino)propanamide
CID 103106976
2-(thiolan-3-ylmethylamino)butanoic acid
CID 107295403
2-(thiolan-3-ylmethylamino)butanamide
CID 107295791
4-methyl-N-(thiolan-3-ylmethyl)hexan-2-amine
CID 107132179
(2S)-2-amino-4-methyl-N-(thiolan-3-ylmethyl)pentanamide
CID 107296003
N-ethyl-N-methyl-2-(oxan-2-ylmethylamino)propanamide
CID 103108703

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide?
The IUPAC name of N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide (CID 107132515) is N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide?
The canonical SMILES for N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide is CCN(C)C(=O)C(C)NCC1CCSC1.
What is the InChIKey of N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide?
The InChIKey is FCBOQWVQQYHSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2OS/c1-4-13(3)11(14)9(2)12-7-10-5-6-15-8-10/h9-10,12H,4-8H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide?
N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide has a molecular weight of 230.38 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(thiolan-3-ylmethylamino)propanamide is sourced from PubChem (CID 107132515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).