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

C14H20ClNO3 — CID 81213880

IUPAC1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol
SMILESOCC1CN(CCC(O)c2cccc(Cl)c2)CCO1
InChIInChI=1S/C14H20ClNO3/c15-12-3-1-2-11(8-12)14(18)4-5-16-6-7-19-13(9-16)10-17/h1-3,8,13-14,17-18H,4-7,9-10H2
InChIKeyOLIKRFVSPLDAGA-UHFFFAOYSA-N
MW285.77 g/mol
LogP1.46
Rot. Bonds5

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

1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol (PubChem CID 81213880) has the molecular formula C14H20ClNO3 and a molecular weight of 285.77 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol
PubChem CID81213880
Molecular FormulaC14H20ClNO3
Molecular Weight285.77 g/mol
Exact Mass285.11
IUPAC Name1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol
SMILESOCC1CN(CCC(O)c2cccc(Cl)c2)CCO1
InChIInChI=1S/C14H20ClNO3/c15-12-3-1-2-11(8-12)14(18)4-5-16-6-7-19-13(9-16)10-17/h1-3,8,13-14,17-18H,4-7,9-10H2
InChIKeyOLIKRFVSPLDAGA-UHFFFAOYSA-N
XLogP1.46
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(hydroxymethyl)morpholin-4-yl]-1-(3-methylphenyl)propan-1-ol
CID 81214348
[4-[2-(3-chlorophenyl)propyl]morpholin-2-yl]methanol
CID 86817957
1-[3-(3-chlorophenyl)-3-hydroxypropyl]pyrrolidin-3-ol
CID 62941193
1-(4-bromo-2-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol
CID 82781196
3-[2-(hydroxymethyl)morpholin-4-yl]-1-(2-methylphenyl)propan-1-ol
CID 81212708
1-(2-bromophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol
CID 81212947
1-(3-chlorophenyl)-3-(3-methoxypiperidin-1-yl)propan-1-ol
CID 102967577
1-(3-chlorophenyl)-3-[4-(2-hydroxyethoxy)piperidin-1-yl]propan-1-ol
CID 82685637
[4-[(4-chloro-2-methylphenyl)methyl]morpholin-2-yl]methanol
CID 91648632
1-(3-chlorophenyl)-3-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]propan-1-ol
CID 102789664
3-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-(3-chlorophenyl)propan-1-ol
CID 102728352
1-(3-chlorophenyl)-3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-ol
CID 62624190

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol?
The IUPAC name of 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol (CID 81213880) is 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol.
What is the SMILES notation for 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol?
The canonical SMILES for 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol is OCC1CN(CCC(O)c2cccc(Cl)c2)CCO1.
What is the InChIKey of 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol?
The InChIKey is OLIKRFVSPLDAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO3/c15-12-3-1-2-11(8-12)14(18)4-5-16-6-7-19-13(9-16)10-17/h1-3,8,13-14,17-18H,4-7,9-10H2.
What are the key properties of 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol?
1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol has a molecular weight of 285.77 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-[2-(hydroxymethyl)morpholin-4-yl]propan-1-ol is sourced from PubChem (CID 81213880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).