3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol

C13H18ClNO2 — CID 110936045

IUPAC3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol
SMILESOCCCN1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C13H18ClNO2/c14-12-5-2-1-4-11(12)13-10-15(6-3-8-16)7-9-17-13/h1-2,4-5,13,16H,3,6-10H2
InChIKeyCKGMITMPQKFYQN-UHFFFAOYSA-N
MW255.74 g/mol
LogP2.10
Rot. Bonds4

About 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol

3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol (PubChem CID 110936045) has the molecular formula C13H18ClNO2 and a molecular weight of 255.74 g/mol. Its IUPAC name is 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol
PubChem CID110936045
Molecular FormulaC13H18ClNO2
Molecular Weight255.74 g/mol
Exact Mass255.10
IUPAC Name3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol
SMILESOCCCN1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C13H18ClNO2/c14-12-5-2-1-4-11(12)13-10-15(6-3-8-16)7-9-17-13/h1-2,4-5,13,16H,3,6-10H2
InChIKeyCKGMITMPQKFYQN-UHFFFAOYSA-N
XLogP2.10
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.74
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol
CID 111432795
4-[(2R)-2-(2-chlorophenyl)morpholin-4-yl]butanoic acid
CID 124564562
3-[2-(2-methylphenyl)morpholin-4-yl]propan-1-ol
CID 111462348
5-[(2R)-2-(2-chlorophenyl)morpholin-4-yl]pentanenitrile
CID 95341250
3-[(2R)-2-(3,4-dichlorophenyl)morpholin-4-yl]propan-1-ol
CID 95175790
(2S)-2-(2-chlorophenyl)-4-(2-pyridin-4-ylethyl)morpholine
CID 95304387
4-[(2R)-2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]butan-1-ol
CID 95339618
(2R)-2-(2-chlorophenyl)-4-(2-pyridin-4-ylethyl)morpholine
CID 95304386
2-(2-chlorophenyl)-4-[[(2S)-1,4-dioxan-2-yl]methyl]morpholine
CID 136589243
3-(12-oxa-10-azatricyclo[6.3.1.02,7]dodeca-2,4,6-trien-10-yl)propan-1-ol
CID 14208749
2-[2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]ethanol;hydrochloride
CID 141261156
6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol
CID 97355587

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol?
The IUPAC name of 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol (CID 110936045) is 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol.
What is the SMILES notation for 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol?
The canonical SMILES for 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol is OCCCN1CCOC(c2ccccc2Cl)C1.
What is the InChIKey of 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol?
The InChIKey is CKGMITMPQKFYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO2/c14-12-5-2-1-4-11(12)13-10-15(6-3-8-16)7-9-17-13/h1-2,4-5,13,16H,3,6-10H2.
What are the key properties of 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol?
3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol has a molecular weight of 255.74 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol is sourced from PubChem (CID 110936045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).