3-phenyl-3-(propylamino)hexan-1-ol

C15H25NO — CID 65234672

IUPAC3-phenyl-3-(propylamino)hexan-1-ol
SMILESCCCNC(CCC)(CCO)c1ccccc1
InChIInChI=1S/C15H25NO/c1-3-10-15(11-13-17,16-12-4-2)14-8-6-5-7-9-14/h5-9,16-17H,3-4,10-13H2,1-2H3
InChIKeyKBJDRZRPYPVUAR-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.06
Rot. Bonds8

About 3-phenyl-3-(propylamino)hexan-1-ol

3-phenyl-3-(propylamino)hexan-1-ol (PubChem CID 65234672) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 3-phenyl-3-(propylamino)hexan-1-ol.

Molecular Properties

Compound Name3-phenyl-3-(propylamino)hexan-1-ol
PubChem CID65234672
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name3-phenyl-3-(propylamino)hexan-1-ol
SMILESCCCNC(CCC)(CCO)c1ccccc1
InChIInChI=1S/C15H25NO/c1-3-10-15(11-13-17,16-12-4-2)14-8-6-5-7-9-14/h5-9,16-17H,3-4,10-13H2,1-2H3
InChIKeyKBJDRZRPYPVUAR-UHFFFAOYSA-N
XLogP3.06
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-fluorophenyl)-3-(propylamino)pentan-1-ol
CID 65235270
3-methylsulfanyl-2-phenyl-2-(propylamino)propan-1-ol
CID 64806019
4-(2-methylpropylsulfanyl)-2-phenyl-2-(propylamino)butan-1-ol
CID 116696144
3-(3,3-dimethylbutoxy)-2-phenyl-2-(propylamino)propan-1-ol
CID 66227107
2-phenyl-2-(propylamino)-4-(2,2,2-trifluoroethoxy)butan-1-ol
CID 116696045
3-hexoxy-2-phenyl-2-(propylamino)propan-1-ol
CID 64811643
3-methyl-5-phenyl-3-(propylamino)pentan-1-ol
CID 65234500
4-methoxy-3-(methylamino)-3-phenylbutan-1-ol
CID 103466320
methyl 3-(ethylamino)-3-phenylhexanoate
CID 65235194
3-(2-cyclobutylethoxy)-2-phenyl-2-(propylamino)propan-1-ol
CID 106206861
3-(2,2-dimethylpyrrolidin-1-yl)-2-phenyl-2-(propylamino)propan-1-ol
CID 64791689
3-(4-chloropyrazol-1-yl)-2-phenyl-2-(propylamino)propan-1-ol
CID 64809031

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-3-(propylamino)hexan-1-ol?
The IUPAC name of 3-phenyl-3-(propylamino)hexan-1-ol (CID 65234672) is 3-phenyl-3-(propylamino)hexan-1-ol.
What is the SMILES notation for 3-phenyl-3-(propylamino)hexan-1-ol?
The canonical SMILES for 3-phenyl-3-(propylamino)hexan-1-ol is CCCNC(CCC)(CCO)c1ccccc1.
What is the InChIKey of 3-phenyl-3-(propylamino)hexan-1-ol?
The InChIKey is KBJDRZRPYPVUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-3-10-15(11-13-17,16-12-4-2)14-8-6-5-7-9-14/h5-9,16-17H,3-4,10-13H2,1-2H3.
What are the key properties of 3-phenyl-3-(propylamino)hexan-1-ol?
3-phenyl-3-(propylamino)hexan-1-ol has a molecular weight of 235.37 g/mol, XLogP of 3.06, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-3-(propylamino)hexan-1-ol is sourced from PubChem (CID 65234672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).