N-propyl-2-(thiolan-2-ylmethylamino)acetamide

C10H20N2OS — CID 80585576

IUPACN-propyl-2-(thiolan-2-ylmethylamino)acetamide
SMILESCCCNC(=O)CNCC1CCCS1
InChIInChI=1S/C10H20N2OS/c1-2-5-12-10(13)8-11-7-9-4-3-6-14-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeySVVSALDMCMRXNJ-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.00
Rot. Bonds6

About N-propyl-2-(thiolan-2-ylmethylamino)acetamide

N-propyl-2-(thiolan-2-ylmethylamino)acetamide (PubChem CID 80585576) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is N-propyl-2-(thiolan-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-propyl-2-(thiolan-2-ylmethylamino)acetamide
PubChem CID80585576
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC NameN-propyl-2-(thiolan-2-ylmethylamino)acetamide
SMILESCCCNC(=O)CNCC1CCCS1
InChIInChI=1S/C10H20N2OS/c1-2-5-12-10(13)8-11-7-9-4-3-6-14-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeySVVSALDMCMRXNJ-UHFFFAOYSA-N
XLogP1.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(thian-2-ylmethylamino)acetamide
CID 80600619
2-(cyclopropylmethylamino)-N-(thian-2-ylmethyl)acetamide
CID 80600083
2-(methylamino)-N-(thiolan-2-ylmethyl)acetamide
CID 80584517
2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride
CID 119790691
N-cyclohexyl-2-(thiolan-2-ylmethylamino)acetamide
CID 80584523
ethyl 2-(thiolan-2-ylmethylamino)acetate
CID 80585602
2-[(4-hydroxycyclohexyl)methylamino]-N-propylacetamide
CID 106133332
2-(prop-2-ynylamino)-N-(thian-2-ylmethyl)acetamide
CID 80600284
methyl 2-(thian-2-ylmethylamino)acetate
CID 80600319
2-amino-N-[2-oxo-2-(thiolan-2-ylmethylamino)ethyl]acetamide
CID 80584787
1-pyrrolidin-1-yl-2-(thian-2-ylmethylamino)ethanone
CID 80600916
N,N-dimethyl-3-(thiolan-2-ylmethylamino)propanamide
CID 80585387

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(thiolan-2-ylmethylamino)acetamide?
The IUPAC name of N-propyl-2-(thiolan-2-ylmethylamino)acetamide (CID 80585576) is N-propyl-2-(thiolan-2-ylmethylamino)acetamide.
What is the SMILES notation for N-propyl-2-(thiolan-2-ylmethylamino)acetamide?
The canonical SMILES for N-propyl-2-(thiolan-2-ylmethylamino)acetamide is CCCNC(=O)CNCC1CCCS1.
What is the InChIKey of N-propyl-2-(thiolan-2-ylmethylamino)acetamide?
The InChIKey is SVVSALDMCMRXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-2-5-12-10(13)8-11-7-9-4-3-6-14-9/h9,11H,2-8H2,1H3,(H,12,13).
What are the key properties of N-propyl-2-(thiolan-2-ylmethylamino)acetamide?
N-propyl-2-(thiolan-2-ylmethylamino)acetamide has a molecular weight of 216.35 g/mol, XLogP of 1.00, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(thiolan-2-ylmethylamino)acetamide is sourced from PubChem (CID 80585576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).