N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide

C12H15ClN2O3 — CID 47421313

IUPACN-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide
SMILESCOc1ccc(Cl)c(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H15ClN2O3/c1-17-9-2-3-10(13)11(8-9)14-12(16)15-4-6-18-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)
InChIKeyGJUAKISZQVQCHR-UHFFFAOYSA-N
MW270.72 g/mol
LogP2.21
Rot. Bonds2

About N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide

N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide (PubChem CID 47421313) has the molecular formula C12H15ClN2O3 and a molecular weight of 270.72 g/mol. Its IUPAC name is N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide
PubChem CID47421313
Molecular FormulaC12H15ClN2O3
Molecular Weight270.72 g/mol
Exact Mass270.08
IUPAC NameN-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide
SMILESCOc1ccc(Cl)c(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H15ClN2O3/c1-17-9-2-3-10(13)11(8-9)14-12(16)15-4-6-18-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)
InChIKeyGJUAKISZQVQCHR-UHFFFAOYSA-N
XLogP2.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-5-methoxyphenyl)morpholine-4-carboxamide
CID 115687771
1-[(2-chloro-5-methoxyphenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63031412
N-(2-chloro-5-methoxyphenyl)-3-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111443203
N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)morpholine-4-carboxamide
CID 47201238
1-[(2-chloro-5-methoxyphenyl)carbamoyl]-5-methylpiperidine-3-carboxylic acid
CID 122102219
N-[2-chloro-5-(piperidine-1-carbonyl)phenyl]morpholine-4-carboxamide
CID 72863358
N-(2,5-dichlorophenyl)-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105995
4-methoxy-2-(pyrrolidine-1-carbonylamino)benzoic acid
CID 113304995
N-[[2-chloro-5-(morpholine-4-carbonyl)phenyl]carbamothioyl]-3-methoxybenzamide
CID 54860110
N-(2-amino-5-methoxyphenyl)piperidine-1-carboxamide
CID 79155990
N-(2-bromo-5-methoxyphenyl)piperidine-1-carboxamide
CID 79156264
N-(2-fluoro-5-methoxyphenyl)azepane-1-carboxamide
CID 115687770

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide (CID 47421313) is N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide is COc1ccc(Cl)c(NC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide?
The InChIKey is GJUAKISZQVQCHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O3/c1-17-9-2-3-10(13)11(8-9)14-12(16)15-4-6-18-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16).
What are the key properties of N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide?
N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide has a molecular weight of 270.72 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 47421313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).