2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine

C14H18ClNO2 — CID 117423163

IUPAC2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine
SMILESClc1ccc(OCC2CC2)c(C2CNCCO2)c1
InChIInChI=1S/C14H18ClNO2/c15-11-3-4-13(18-9-10-1-2-10)12(7-11)14-8-16-5-6-17-14/h3-4,7,10,14,16H,1-2,5-6,8-9H2
InChIKeyOWWWXORYUIHOGO-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.79
Rot. Bonds4

About 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine

2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine (PubChem CID 117423163) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine.

Molecular Properties

Compound Name2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine
PubChem CID117423163
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine
SMILESClc1ccc(OCC2CC2)c(C2CNCCO2)c1
InChIInChI=1S/C14H18ClNO2/c15-11-3-4-13(18-9-10-1-2-10)12(7-11)14-8-16-5-6-17-14/h3-4,7,10,14,16H,1-2,5-6,8-9H2
InChIKeyOWWWXORYUIHOGO-UHFFFAOYSA-N
XLogP2.79
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-chloro-3-methoxynaphthalen-2-yl)morpholine
CID 117445267
(3S)-3-[(2,4-dichlorophenoxy)methyl]pyrrolidine
CID 86320973
2-(3-chloro-4-ethoxyphenyl)morpholine
CID 82293187
2-(5-chloro-3-methoxy-2-methylphenyl)morpholine
CID 117356511
5-chloro-2-morpholin-2-ylbenzoic acid
CID 174949495
CID 161270720
CID 161270720
4-chloro-2-fluoro-6-morpholin-2-ylphenol
CID 117335358
N-[[5-chloro-2-(cyclopropylmethoxy)phenyl]methyl]-1-[(3R)-pyrrolidin-3-yl]methanamine;hydrochloride
CID 171620502
2-(5-bromo-2-cyclopropyloxyphenyl)morpholine
CID 117479953
(3S)-3-[(2,5-dichlorophenoxy)methyl]piperidine
CID 26190671
(3R)-3-[(2-tert-butyl-4-chlorophenoxy)methyl]pyrrolidine
CID 86320408
1-[[5-chloro-2-(cyclopropylmethoxy)phenyl]methyl]piperazine
CID 117450901

Frequently Asked Questions

What is the IUPAC name of 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine?
The IUPAC name of 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine (CID 117423163) is 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine.
What is the SMILES notation for 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine?
The canonical SMILES for 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine is Clc1ccc(OCC2CC2)c(C2CNCCO2)c1.
What is the InChIKey of 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine?
The InChIKey is OWWWXORYUIHOGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c15-11-3-4-13(18-9-10-1-2-10)12(7-11)14-8-16-5-6-17-14/h3-4,7,10,14,16H,1-2,5-6,8-9H2.
What are the key properties of 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine?
2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine has a molecular weight of 267.76 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-chloro-2-(cyclopropylmethoxy)phenyl]morpholine is sourced from PubChem (CID 117423163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).