1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea

C24H26ClN3O2 — CID 142661459

IUPAC1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea
SMILESCN(C(=O)NCC1CN(Cc2cccc3ccccc23)CCO1)c1ccc(Cl)cc1
InChIInChI=1S/C24H26ClN3O2/c1-27(21-11-9-20(25)10-12-21)24(29)26-15-22-17-28(13-14-30-22)16-19-7-4-6-18-5-2-3-8-23(18)19/h2-12,22H,13-17H2,1H3,(H,26,29)
InChIKeyBWLRSWQGCNCTGP-UHFFFAOYSA-N
MW423.94 g/mol
LogP4.54
Rot. Bonds5

About 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea

1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea (PubChem CID 142661459) has the molecular formula C24H26ClN3O2 and a molecular weight of 423.94 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea.

Molecular Properties

Compound Name1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea
PubChem CID142661459
Molecular FormulaC24H26ClN3O2
Molecular Weight423.94 g/mol
Exact Mass423.17
IUPAC Name1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea
SMILESCN(C(=O)NCC1CN(Cc2cccc3ccccc23)CCO1)c1ccc(Cl)cc1
InChIInChI=1S/C24H26ClN3O2/c1-27(21-11-9-20(25)10-12-21)24(29)26-15-22-17-28(13-14-30-22)16-19-7-4-6-18-5-2-3-8-23(18)19/h2-12,22H,13-17H2,1H3,(H,26,29)
InChIKeyBWLRSWQGCNCTGP-UHFFFAOYSA-N
XLogP4.54
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.94
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea 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

N-[[(2R)-4-[(2,3-dimethoxyphenyl)methyl]morpholin-2-yl]methyl]acetamide
CID 124614604
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-2-(4-methoxyphenyl)acetamide
CID 39472023
N-[(4-benzylmorpholin-2-yl)methyl]-3-(dimethylamino)benzamide
CID 78799093
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2-(2-fluorophenyl)acetamide
CID 39472038
(2R)-2-amino-N-[(4-benzylmorpholin-2-yl)methyl]propanamide
CID 119829876
(2S)-2-amino-N-[(4-benzylmorpholin-2-yl)methyl]propanamide
CID 119829898
1-[(4-chlorophenyl)methyl]-3-[[4-[(3-iodophenyl)methyl]morpholin-2-yl]methyl]urea
CID 10278623
methyl 2-[(2R)-4-[(2-chlorophenyl)methyl]morpholin-2-yl]acetate
CID 97062552
(2R)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-N-[[(2S)-oxolan-2-yl]methyl]propanamide
CID 30625134
(2R)-2-acetamido-N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-3-(1H-indol-3-yl)propanamide
CID 39472754
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide
CID 8504076

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea?
The IUPAC name of 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea (CID 142661459) is 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea.
What is the SMILES notation for 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea?
The canonical SMILES for 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea is CN(C(=O)NCC1CN(Cc2cccc3ccccc23)CCO1)c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea?
The InChIKey is BWLRSWQGCNCTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClN3O2/c1-27(21-11-9-20(25)10-12-21)24(29)26-15-22-17-28(13-14-30-22)16-19-7-4-6-18-5-2-3-8-23(18)19/h2-12,22H,13-17H2,1H3,(H,26,29).
What are the key properties of 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea?
1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea has a molecular weight of 423.94 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-1-methyl-3-[[4-(naphthalen-1-ylmethyl)morpholin-2-yl]methyl]urea is sourced from PubChem (CID 142661459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).