N-(thiolan-2-ylmethyl)morpholine-2-carboxamide

C10H18N2O2S — CID 80584597

IUPACN-(thiolan-2-ylmethyl)morpholine-2-carboxamide
SMILESO=C(NCC1CCCS1)C1CNCCO1
InChIInChI=1S/C10H18N2O2S/c13-10(9-7-11-3-4-14-9)12-6-8-2-1-5-15-8/h8-9,11H,1-7H2,(H,12,13)
InChIKeyWPFGKYWVAHLTAT-UHFFFAOYSA-N
MW230.33 g/mol
LogP-0.01
Rot. Bonds3

About N-(thiolan-2-ylmethyl)morpholine-2-carboxamide

N-(thiolan-2-ylmethyl)morpholine-2-carboxamide (PubChem CID 80584597) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is N-(thiolan-2-ylmethyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-(thiolan-2-ylmethyl)morpholine-2-carboxamide
PubChem CID80584597
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC NameN-(thiolan-2-ylmethyl)morpholine-2-carboxamide
SMILESO=C(NCC1CCCS1)C1CNCCO1
InChIInChI=1S/C10H18N2O2S/c13-10(9-7-11-3-4-14-9)12-6-8-2-1-5-15-8/h8-9,11H,1-7H2,(H,12,13)
InChIKeyWPFGKYWVAHLTAT-UHFFFAOYSA-N
XLogP-0.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
(3R)-N-(thiolan-2-ylmethyl)piperidine-3-carboxamide
CID 81135090
(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
CID 130702713
N-[(3-hydroxycyclopentyl)methyl]morpholine-2-carboxamide
CID 106134080
N-[2-(cyclopropanecarbonylamino)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119687765
N-(3-cyclopentylpropyl)morpholine-2-carboxamide
CID 113266264
N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]morpholine-2-carboxamide
CID 65119743
N-[(4-butylcyclohexyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 119750312
(2S)-N-cyclopentylmorpholine-2-carboxamide
CID 92614945
4-hydroxy-N-(thiolan-2-ylmethyl)pyrrolidine-2-carboxamide
CID 80584481
N-(3-cyclohexylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119724280
N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]morpholine-2-carboxamide;dihydrochloride
CID 119854716

Frequently Asked Questions

What is the IUPAC name of N-(thiolan-2-ylmethyl)morpholine-2-carboxamide?
The IUPAC name of N-(thiolan-2-ylmethyl)morpholine-2-carboxamide (CID 80584597) is N-(thiolan-2-ylmethyl)morpholine-2-carboxamide.
What is the SMILES notation for N-(thiolan-2-ylmethyl)morpholine-2-carboxamide?
The canonical SMILES for N-(thiolan-2-ylmethyl)morpholine-2-carboxamide is O=C(NCC1CCCS1)C1CNCCO1.
What is the InChIKey of N-(thiolan-2-ylmethyl)morpholine-2-carboxamide?
The InChIKey is WPFGKYWVAHLTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S/c13-10(9-7-11-3-4-14-9)12-6-8-2-1-5-15-8/h8-9,11H,1-7H2,(H,12,13).
What are the key properties of N-(thiolan-2-ylmethyl)morpholine-2-carboxamide?
N-(thiolan-2-ylmethyl)morpholine-2-carboxamide has a molecular weight of 230.33 g/mol, XLogP of -0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiolan-2-ylmethyl)morpholine-2-carboxamide is sourced from PubChem (CID 80584597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).