(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride

C9H18ClN3O2 — CID 130702713

IUPAC(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CNC1)[C@H]1CNCCO1
InChIInChI=1S/C9H17N3O2.ClH/c13-9(8-6-10-1-2-14-8)12-5-7-3-11-4-7;/h7-8,10-11H,1-6H2,(H,12,13);1H/t8-;/m1./s1
InChIKeyOXSIAOZPNWHTDR-DDWIOCJRSA-N
MW235.71 g/mol
LogP-1.27
Rot. Bonds3

About (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride

(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 130702713) has the molecular formula C9H18ClN3O2 and a molecular weight of 235.71 g/mol. Its IUPAC name is (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
PubChem CID130702713
Molecular FormulaC9H18ClN3O2
Molecular Weight235.71 g/mol
Exact Mass235.11
IUPAC Name(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CNC1)[C@H]1CNCCO1
InChIInChI=1S/C9H17N3O2.ClH/c13-9(8-6-10-1-2-14-8)12-5-7-3-11-4-7;/h7-8,10-11H,1-6H2,(H,12,13);1H/t8-;/m1./s1
InChIKeyOXSIAOZPNWHTDR-DDWIOCJRSA-N
XLogP-1.27
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.71
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
N-[(3-hydroxycyclopentyl)methyl]morpholine-2-carboxamide
CID 106134080
N-[(4-butylcyclohexyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 119750312
N-[2-(cyclopropanecarbonylamino)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119687765
N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]morpholine-2-carboxamide;dihydrochloride
CID 119854716
(2R)-N-(2-aminopropyl)morpholine-2-carboxamide;hydrochloride
CID 130680040
N-(thiolan-2-ylmethyl)morpholine-2-carboxamide
CID 80584597
N-(3-cyclohexylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119724280
N-(3-cyclopentylpropyl)morpholine-2-carboxamide
CID 113266264
N-(3-methylsulfanylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119706942
N-[2-(cyclobutylmethylsulfamoyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119782566
N-octylmorpholine-2-carboxamide
CID 115567943

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride (CID 130702713) is (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride is Cl.O=C(NCC1CNC1)[C@H]1CNCCO1.
What is the InChIKey of (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is OXSIAOZPNWHTDR-DDWIOCJRSA-N. The full InChI is InChI=1S/C9H17N3O2.ClH/c13-9(8-6-10-1-2-14-8)12-5-7-3-11-4-7;/h7-8,10-11H,1-6H2,(H,12,13);1H/t8-;/m1./s1.
What are the key properties of (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride?
(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 235.71 g/mol, XLogP of -1.27, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 130702713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).