2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide

C11H20N2O2S — CID 60944233

IUPAC2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide
SMILESNCC(=O)N(CC1CCCO1)C1CCSC1
InChIInChI=1S/C11H20N2O2S/c12-6-11(14)13(9-3-5-16-8-9)7-10-2-1-4-15-10/h9-10H,1-8,12H2
InChIKeySBKZOFHSRBAAKM-UHFFFAOYSA-N
MW244.36 g/mol
LogP0.46
Rot. Bonds4

About 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide

2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide (PubChem CID 60944233) has the molecular formula C11H20N2O2S and a molecular weight of 244.36 g/mol. Its IUPAC name is 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide
PubChem CID60944233
Molecular FormulaC11H20N2O2S
Molecular Weight244.36 g/mol
Exact Mass244.12
IUPAC Name2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide
SMILESNCC(=O)N(CC1CCCO1)C1CCSC1
InChIInChI=1S/C11H20N2O2S/c12-6-11(14)13(9-3-5-16-8-9)7-10-2-1-4-15-10/h9-10H,1-8,12H2
InChIKeySBKZOFHSRBAAKM-UHFFFAOYSA-N
XLogP0.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(oxolan-2-ylmethyl)-2-piperidin-4-yl-N-(thiolan-3-yl)acetamide
CID 61029247
(2S)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)butanamide
CID 61163740
3-(ethylamino)-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)butanamide
CID 62838859
2-(methylamino)-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)propanamide
CID 62638054
N-[[(2R)-oxolan-2-yl]methyl]-1-prop-2-ynyl-N-[(3R)-thiolan-3-yl]piperidine-4-carboxamide
CID 95764870
5-chloro-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80625955
4-methyl-N-[[(2S)-oxolan-2-yl]methyl]-N-[(3S)-thiolan-3-yl]thiophene-3-carboxamide
CID 97008483
N-[[(2R)-oxolan-2-yl]methyl]-3-phenyl-N-[(3R)-thiolan-3-yl]prop-2-ynamide
CID 96569970
5-bromo-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)furan-2-carboxamide
CID 55613442
2-(2,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide
CID 55613713
1-methylsulfonyl-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)piperidine-3-carboxamide
CID 55613299
5-chloro-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]-N-[(3R)-thiolan-3-yl]-1H-pyridine-3-carboxamide
CID 97313157

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide?
The IUPAC name of 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide (CID 60944233) is 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide.
What is the SMILES notation for 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide?
The canonical SMILES for 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide is NCC(=O)N(CC1CCCO1)C1CCSC1.
What is the InChIKey of 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide?
The InChIKey is SBKZOFHSRBAAKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S/c12-6-11(14)13(9-3-5-16-8-9)7-10-2-1-4-15-10/h9-10H,1-8,12H2.
What are the key properties of 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide?
2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide has a molecular weight of 244.36 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)acetamide is sourced from PubChem (CID 60944233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).