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

C12H16N2O3 — CID 759969

IUPACN-(2-methoxyphenyl)morpholine-4-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCOCC1
InChIInChI=1S/C12H16N2O3/c1-16-11-5-3-2-4-10(11)13-12(15)14-6-8-17-9-7-14/h2-5H,6-9H2,1H3,(H,13,15)
InChIKeyKACWEMYQLYXRGK-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.56
Rot. Bonds2

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

N-(2-methoxyphenyl)morpholine-4-carboxamide (PubChem CID 759969) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-(2-methoxyphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)morpholine-4-carboxamide
PubChem CID759969
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC NameN-(2-methoxyphenyl)morpholine-4-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCOCC1
InChIInChI=1S/C12H16N2O3/c1-16-11-5-3-2-4-10(11)13-12(15)14-6-8-17-9-7-14/h2-5H,6-9H2,1H3,(H,13,15)
InChIKeyKACWEMYQLYXRGK-UHFFFAOYSA-N
XLogP1.56
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Urapidil
CID 5639
1-(2-Methoxyphenyl)piperazine
CID 1346
Acetamide, N-(2-methoxyphenyl)-
CID 7135
5-Methylurapidil
CID 5640
3-Methyl-3,4-dihydro-2H-1,4-benzoxazine
CID 2763760
N-(2-Methoxyphenyl)piperazine hydrochloride
CID 9899402
Urapidil hydrochloride
CID 167980
o-Ethoxyacetanilide
CID 11383
1-(2-Ethoxyphenyl)piperazine
CID 83357
1-Piperidinecarboxamide, N-(4-methoxyphenyl)-
CID 200753
1-[2-(Propan-2-yloxy)phenyl]piperazine
CID 10944016
GW542573X
CID 24885053

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)morpholine-4-carboxamide (CID 759969) is N-(2-methoxyphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)morpholine-4-carboxamide is COc1ccccc1NC(=O)N1CCOCC1.
What is the InChIKey of N-(2-methoxyphenyl)morpholine-4-carboxamide?
The InChIKey is KACWEMYQLYXRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-16-11-5-3-2-4-10(11)13-12(15)14-6-8-17-9-7-14/h2-5H,6-9H2,1H3,(H,13,15).
What are the key properties of N-(2-methoxyphenyl)morpholine-4-carboxamide?
N-(2-methoxyphenyl)morpholine-4-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 759969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).