3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea

C19H24N2O3 — CID 52503085

IUPAC3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea
SMILESCOc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-14(13-15-9-11-16(23-3)12-10-15)21(2)19(22)20-17-7-5-6-8-18(17)24-4/h5-12,14H,13H2,1-4H3,(H,20,22)/t14-/m1/s1
InChIKeyGHKXDHQEDBKMPM-CQSZACIVSA-N
MW328.41 g/mol
LogP3.80
Rot. Bonds6

About 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea

3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea (PubChem CID 52503085) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea
PubChem CID52503085
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea
SMILESCOc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-14(13-15-9-11-16(23-3)12-10-15)21(2)19(22)20-17-7-5-6-8-18(17)24-4/h5-12,14H,13H2,1-4H3,(H,20,22)/t14-/m1/s1
InChIKeyGHKXDHQEDBKMPM-CQSZACIVSA-N
XLogP3.80
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-fluorophenyl)-1-[(2S)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea
CID 52505851
1-(4-aminobutan-2-yl)-3-(2-methoxyphenyl)-1-methylurea
CID 63225235
1-benzyl-3-(2-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]urea
CID 47053425
3-[(3,4-dimethoxyphenyl)methyl]-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea
CID 52510628
3-(2-methoxyphenyl)-1,1-dimethylurea
CID 4216204
(2S)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(2-methoxyphenyl)propanamide
CID 9054255
1-(2-aminopropyl)-3-(2-methoxyphenyl)-1-methylurea
CID 63766734
1-(2-methoxyphenyl)-3-[1-(4-methoxyphenyl)propyl]urea
CID 78798433
[4-[[[(2S)-butan-2-yl]-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate
CID 7411611
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
3-(2-methoxyphenyl)-1-methyl-1-[[4-(trifluoromethoxy)phenyl]methyl]urea
CID 55570707
1-[(4-bromophenyl)methyl]-3-(2-methoxyphenyl)-1-methylurea
CID 31770982

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea?
The IUPAC name of 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea (CID 52503085) is 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea.
What is the SMILES notation for 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea?
The canonical SMILES for 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea is COc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2OC)cc1.
What is the InChIKey of 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea?
The InChIKey is GHKXDHQEDBKMPM-CQSZACIVSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-14(13-15-9-11-16(23-3)12-10-15)21(2)19(22)20-17-7-5-6-8-18(17)24-4/h5-12,14H,13H2,1-4H3,(H,20,22)/t14-/m1/s1.
What are the key properties of 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea?
3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea has a molecular weight of 328.41 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1-[(2R)-1-(4-methoxyphenyl)propan-2-yl]-1-methylurea is sourced from PubChem (CID 52503085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).