1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea

C19H23ClN2O2 — CID 51935182

IUPAC1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea
SMILESCOc1ccc(CCNC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14(16-6-8-17(20)9-7-16)22(2)19(23)21-13-12-15-4-10-18(24-3)11-5-15/h4-11,14H,12-13H2,1-3H3,(H,21,23)/t14-/m1/s1
InChIKeyAEBZBKXVHJZKQU-CQSZACIVSA-N
MW346.86 g/mol
LogP4.29
Rot. Bonds6

About 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea

1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea (PubChem CID 51935182) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea.

Molecular Properties

Compound Name1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea
PubChem CID51935182
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea
SMILESCOc1ccc(CCNC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14(16-6-8-17(20)9-7-16)22(2)19(23)21-13-12-15-4-10-18(24-3)11-5-15/h4-11,14H,12-13H2,1-3H3,(H,21,23)/t14-/m1/s1
InChIKeyAEBZBKXVHJZKQU-CQSZACIVSA-N
XLogP4.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea with MolForge

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Related Compounds

1-[(1S)-1-(4-fluorophenyl)ethyl]-1-methyl-3-[2-(4-propan-2-ylphenyl)ethyl]urea
CID 41096953
3-butyl-1-[1-(4-chlorophenyl)ethyl]-1-methylurea
CID 113221619
3-acetamido-N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)propanamide
CID 46520293
2-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-3-pyridin-4-ylpropanamide
CID 110296857
3-amino-1-[1-(4-chlorophenyl)ethyl]-1-methylurea
CID 62979253
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] (2S)-2-(4-chlorophenoxy)propanoate
CID 8867295
2-(4-chloro-N-methylsulfonylanilino)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 4214527
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 24511975
3-(4-chlorophenyl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 2634604
[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl] 2-(4-chlorophenoxy)acetate
CID 55416665
(2R)-2-hydroxy-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 175743514
1-[1-(3-chloro-4-fluorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 60580849

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea?
The IUPAC name of 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea (CID 51935182) is 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea.
What is the SMILES notation for 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea?
The canonical SMILES for 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea is COc1ccc(CCNC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea?
The InChIKey is AEBZBKXVHJZKQU-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-14(16-6-8-17(20)9-7-16)22(2)19(23)21-13-12-15-4-10-18(24-3)11-5-15/h4-11,14H,12-13H2,1-3H3,(H,21,23)/t14-/m1/s1.
What are the key properties of 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea?
1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea has a molecular weight of 346.86 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(4-chlorophenyl)ethyl]-3-[2-(4-methoxyphenyl)ethyl]-1-methylurea is sourced from PubChem (CID 51935182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).