(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide

C14H20N2O3 — CID 97157333

IUPAC(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide
SMILESCOc1ccc(CCN2CCOC[C@H]2C(N)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-18-12-4-2-11(3-5-12)6-7-16-8-9-19-10-13(16)14(15)17/h2-5,13H,6-10H2,1H3,(H2,15,17)/t13-/m0/s1
InChIKeyAOAYDQGZMHVACA-ZDUSSCGKSA-N
MW264.32 g/mol
LogP0.42
Rot. Bonds5

About (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide

(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide (PubChem CID 97157333) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide
PubChem CID97157333
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide
SMILESCOc1ccc(CCN2CCOC[C@H]2C(N)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-18-12-4-2-11(3-5-12)6-7-16-8-9-19-10-13(16)14(15)17/h2-5,13H,6-10H2,1H3,(H2,15,17)/t13-/m0/s1
InChIKeyAOAYDQGZMHVACA-ZDUSSCGKSA-N
XLogP0.42
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-(4-aminophenyl)ethyl]-N-methylmorpholine-3-carboxamide
CID 83106155
[1-[2-(4-methoxyphenyl)ethyl]piperidin-2-yl]-morpholin-4-ylmethanone
CID 136522970
4-[(3-amino-5-methoxyphenyl)methyl]morpholine-3-carboxamide
CID 83101676
1-[2-(4-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 9442958
4-[[4-(aminomethyl)phenyl]methyl]morpholine-3-carboxamide
CID 83101444
N-[[4-[2-(4-methoxyphenyl)ethyl]morpholin-3-yl]methyl]ethanamine
CID 83100882
(3S)-4-[4-(4-methoxyphenyl)butanoyl]morpholine-3-carboxylic acid
CID 125133614
4-hexylmorpholine-3-carboxamide
CID 174697838
5-[(3-carbamoylmorpholin-4-yl)methyl]furan-2-carboxylic acid
CID 83095889
4-[2-(3-carbamothioylphenoxy)ethyl]morpholine-3-carboxamide
CID 83098097
4-[(4-methoxyphenyl)methyl]-3-methylmorpholine
CID 67042011
4-(pyridin-4-ylmethyl)morpholine-3-carboxamide
CID 132970427

Frequently Asked Questions

What is the IUPAC name of (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The IUPAC name of (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide (CID 97157333) is (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The canonical SMILES for (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide is COc1ccc(CCN2CCOC[C@H]2C(N)=O)cc1.
What is the InChIKey of (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The InChIKey is AOAYDQGZMHVACA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-18-12-4-2-11(3-5-12)6-7-16-8-9-19-10-13(16)14(15)17/h2-5,13H,6-10H2,1H3,(H2,15,17)/t13-/m0/s1.
What are the key properties of (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide?
(3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 0.42, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-4-[2-(4-methoxyphenyl)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 97157333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).