N-(2-chloroprop-2-enyl)morpholine-3-carboxamide

C8H13ClN2O2 — CID 115739704

IUPACN-(2-chloroprop-2-enyl)morpholine-3-carboxamide
SMILESC=C(Cl)CNC(=O)C1COCCN1
InChIInChI=1S/C8H13ClN2O2/c1-6(9)4-11-8(12)7-5-13-3-2-10-7/h7,10H,1-5H2,(H,11,12)
InChIKeyUHOSFYAMIRHEKH-UHFFFAOYSA-N
MW204.66 g/mol
LogP-0.16
Rot. Bonds3

About N-(2-chloroprop-2-enyl)morpholine-3-carboxamide

N-(2-chloroprop-2-enyl)morpholine-3-carboxamide (PubChem CID 115739704) has the molecular formula C8H13ClN2O2 and a molecular weight of 204.66 g/mol. Its IUPAC name is N-(2-chloroprop-2-enyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloroprop-2-enyl)morpholine-3-carboxamide
PubChem CID115739704
Molecular FormulaC8H13ClN2O2
Molecular Weight204.66 g/mol
Exact Mass204.07
IUPAC NameN-(2-chloroprop-2-enyl)morpholine-3-carboxamide
SMILESC=C(Cl)CNC(=O)C1COCCN1
InChIInChI=1S/C8H13ClN2O2/c1-6(9)4-11-8(12)7-5-13-3-2-10-7/h7,10H,1-5H2,(H,11,12)
InChIKeyUHOSFYAMIRHEKH-UHFFFAOYSA-N
XLogP-0.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
(2R)-N-(2-chloroprop-2-enyl)azetidine-2-carboxamide;hydrochloride
CID 131107148
N-[2-(tert-butylamino)-2-oxoethyl]morpholine-3-carboxamide;hydrochloride
CID 119692656
(3R)-N-(2-aminoethyl)morpholine-3-carboxamide;hydrochloride
CID 130616444
N-[2-(4-bromoanilino)-2-oxoethyl]morpholine-3-carboxamide;hydrochloride
CID 119737995
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631
2-hydroxy-3-(morpholine-3-carbonylamino)propanoic acid
CID 66167386
2-(morpholine-3-carbonylamino)ethyl carbamate
CID 83209608
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide
CID 103811312
N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
CID 119741853
N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide
CID 114150111
2-[2-[(morpholine-3-carbonylamino)methyl]phenyl]acetic acid
CID 81317493

Frequently Asked Questions

What is the IUPAC name of N-(2-chloroprop-2-enyl)morpholine-3-carboxamide?
The IUPAC name of N-(2-chloroprop-2-enyl)morpholine-3-carboxamide (CID 115739704) is N-(2-chloroprop-2-enyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(2-chloroprop-2-enyl)morpholine-3-carboxamide?
The canonical SMILES for N-(2-chloroprop-2-enyl)morpholine-3-carboxamide is C=C(Cl)CNC(=O)C1COCCN1.
What is the InChIKey of N-(2-chloroprop-2-enyl)morpholine-3-carboxamide?
The InChIKey is UHOSFYAMIRHEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13ClN2O2/c1-6(9)4-11-8(12)7-5-13-3-2-10-7/h7,10H,1-5H2,(H,11,12).
What are the key properties of N-(2-chloroprop-2-enyl)morpholine-3-carboxamide?
N-(2-chloroprop-2-enyl)morpholine-3-carboxamide has a molecular weight of 204.66 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloroprop-2-enyl)morpholine-3-carboxamide is sourced from PubChem (CID 115739704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).