N-cycloheptylmorpholine-3-carboxamide;hydrochloride

C12H23ClN2O2 — CID 119674644

IUPACN-cycloheptylmorpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCCC1)C1COCCN1
InChIInChI=1S/C12H22N2O2.ClH/c15-12(11-9-16-8-7-13-11)14-10-5-3-1-2-4-6-10;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyKEYIDTAEZWAUTI-UHFFFAOYSA-N
MW262.78 g/mol
LogP1.24
Rot. Bonds2

About N-cycloheptylmorpholine-3-carboxamide;hydrochloride

N-cycloheptylmorpholine-3-carboxamide;hydrochloride (PubChem CID 119674644) has the molecular formula C12H23ClN2O2 and a molecular weight of 262.78 g/mol. Its IUPAC name is N-cycloheptylmorpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cycloheptylmorpholine-3-carboxamide;hydrochloride
PubChem CID119674644
Molecular FormulaC12H23ClN2O2
Molecular Weight262.78 g/mol
Exact Mass262.14
IUPAC NameN-cycloheptylmorpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCCCC1)C1COCCN1
InChIInChI=1S/C12H22N2O2.ClH/c15-12(11-9-16-8-7-13-11)14-10-5-3-1-2-4-6-10;/h10-11,13H,1-9H2,(H,14,15);1H
InChIKeyKEYIDTAEZWAUTI-UHFFFAOYSA-N
XLogP1.24
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-pyrrolidin-3-ylmorpholine-3-carboxamide;hydrochloride
CID 130748088
N-(2-cyclohexylcyclopropyl)morpholine-3-carboxamide;hydrochloride
CID 119803887
N-(2-methylcyclohexyl)morpholine-3-carboxamide;hydrochloride
CID 119676476
N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]morpholine-3-carboxamide
CID 119808763
N-[(1R,2R)-2-hydroxycyclohexyl]morpholine-3-carboxamide
CID 107222110
N-(1-cyclohexylethyl)morpholine-3-carboxamide;hydrochloride
CID 119705705
1-cyclohexyl-3-[1-(morpholine-3-carbonyl)piperidin-4-yl]urea;hydrochloride
CID 119750464
N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
CID 119741853
(2S)-N-(oxan-3-yl)piperidine-2-carboxamide
CID 103810399
N-(1-cyclopropylpyrrolidin-3-yl)morpholine-3-carboxamide;dihydrochloride
CID 119864795
N-cyclopentylazepane-2-carboxamide
CID 64564743
N-(3-ethylsulfinylcyclohexyl)morpholine-3-carboxamide
CID 119818891

Frequently Asked Questions

What is the IUPAC name of N-cycloheptylmorpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-cycloheptylmorpholine-3-carboxamide;hydrochloride (CID 119674644) is N-cycloheptylmorpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-cycloheptylmorpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-cycloheptylmorpholine-3-carboxamide;hydrochloride is Cl.O=C(NC1CCCCCC1)C1COCCN1.
What is the InChIKey of N-cycloheptylmorpholine-3-carboxamide;hydrochloride?
The InChIKey is KEYIDTAEZWAUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.ClH/c15-12(11-9-16-8-7-13-11)14-10-5-3-1-2-4-6-10;/h10-11,13H,1-9H2,(H,14,15);1H.
What are the key properties of N-cycloheptylmorpholine-3-carboxamide;hydrochloride?
N-cycloheptylmorpholine-3-carboxamide;hydrochloride has a molecular weight of 262.78 g/mol, XLogP of 1.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptylmorpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119674644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).