4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol

C14H20ClNO2 — CID 117427567

IUPAC4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol
SMILESCc1c(Cl)cc(C(C)C)c(O)c1C1CNCCO1
InChIInChI=1S/C14H20ClNO2/c1-8(2)10-6-11(15)9(3)13(14(10)17)12-7-16-4-5-18-12/h6,8,12,16-17H,4-5,7H2,1-3H3
InChIKeyCVWUHHMYJYRRIN-UHFFFAOYSA-N
MW269.77 g/mol
LogP3.14
Rot. Bonds2

About 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol

4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol (PubChem CID 117427567) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol.

Molecular Properties

Compound Name4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol
PubChem CID117427567
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol
SMILESCc1c(Cl)cc(C(C)C)c(O)c1C1CNCCO1
InChIInChI=1S/C14H20ClNO2/c1-8(2)10-6-11(15)9(3)13(14(10)17)12-7-16-4-5-18-12/h6,8,12,16-17H,4-5,7H2,1-3H3
InChIKeyCVWUHHMYJYRRIN-UHFFFAOYSA-N
XLogP3.14
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol 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

2-chloro-6-methyl-4-morpholin-2-ylphenol
CID 84791758
4-chloro-2-methoxy-3,5-dimethyl-6-morpholin-2-ylphenol
CID 117432136
3-chloro-6-methoxy-4-methyl-2-morpholin-2-ylphenol
CID 117397860
3-bromo-2,5-dimethyl-6-morpholin-2-ylphenol
CID 115004627
2-(3-chloro-4-methoxy-5-propan-2-ylphenyl)morpholine
CID 117427563
2-(7-chloro-5-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)morpholine
CID 117427284
2-morpholin-2-yl-5-propan-2-ylphenol
CID 117316057
5-[5-chloro-3-(1-chloroethyl)-2-methoxy-6-methylphenyl]-1,3-oxazolidine
CID 151576016
2-(4-chloro-2,3-dimethoxy-6-methylphenyl)morpholine
CID 117432137
2-methyl-5-morpholin-2-ylbenzene-1,4-diol
CID 117298411
2,6-dimethyl-3-morpholin-2-ylphenol
CID 117296490
4-bromo-2-methyl-6-morpholin-2-ylphenol
CID 117432760

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol?
The IUPAC name of 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol (CID 117427567) is 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol.
What is the SMILES notation for 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol?
The canonical SMILES for 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol is Cc1c(Cl)cc(C(C)C)c(O)c1C1CNCCO1.
What is the InChIKey of 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol?
The InChIKey is CVWUHHMYJYRRIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-8(2)10-6-11(15)9(3)13(14(10)17)12-7-16-4-5-18-12/h6,8,12,16-17H,4-5,7H2,1-3H3.
What are the key properties of 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol?
4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol has a molecular weight of 269.77 g/mol, XLogP of 3.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-methyl-2-morpholin-2-yl-6-propan-2-ylphenol is sourced from PubChem (CID 117427567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).