1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol

C15H26N2O2 — CID 60710601

IUPAC1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol
SMILESCCN(CC)CC(O)CNCC(O)c1ccccc1
InChIInChI=1S/C15H26N2O2/c1-3-17(4-2)12-14(18)10-16-11-15(19)13-8-6-5-7-9-13/h5-9,14-16,18-19H,3-4,10-12H2,1-2H3
InChIKeyFAEWLZHXLCMFQW-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.01
Rot. Bonds9

About 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol

1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol (PubChem CID 60710601) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol
PubChem CID60710601
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol
SMILESCCN(CC)CC(O)CNCC(O)c1ccccc1
InChIInChI=1S/C15H26N2O2/c1-3-17(4-2)12-14(18)10-16-11-15(19)13-8-6-5-7-9-13/h5-9,14-16,18-19H,3-4,10-12H2,1-2H3
InChIKeyFAEWLZHXLCMFQW-UHFFFAOYSA-N
XLogP1.01
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-2-[2-(diethylamino)ethylamino]-1-phenylethanol
CID 93032029
(1R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]-1-phenylethanol
CID 902475
(1S)-2-(ethylamino)-1-phenylethanol
CID 38989247
2-(2-methylpropylamino)-1-phenylethanol
CID 3939463
1-phenyl-2-(2-phenylpropylamino)ethanol
CID 17158257
(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol
CID 67763390
3-hydroxy-4-[(2-hydroxy-2-phenylethyl)amino]butanoic acid
CID 103238121
1-(diethylamino)-3-[(2-fluorophenyl)methylamino]propan-2-ol
CID 60710845
1-(diethylamino)-3-(4-phenylbutan-2-ylamino)propan-2-ol
CID 60710732
(2R)-1-benzhydryloxy-3-(diethylamino)propan-2-ol
CID 2327359
2-[(2-methoxy-2-phenylethyl)amino]-1-phenylethanol
CID 110176855
1-phenyl-2-(prop-2-ynylamino)ethanol
CID 4724225

Frequently Asked Questions

What is the IUPAC name of 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol?
The IUPAC name of 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol (CID 60710601) is 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol.
What is the SMILES notation for 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol?
The canonical SMILES for 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol is CCN(CC)CC(O)CNCC(O)c1ccccc1.
What is the InChIKey of 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol?
The InChIKey is FAEWLZHXLCMFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-17(4-2)12-14(18)10-16-11-15(19)13-8-6-5-7-9-13/h5-9,14-16,18-19H,3-4,10-12H2,1-2H3.
What are the key properties of 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol?
1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol has a molecular weight of 266.38 g/mol, XLogP of 1.01, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)-3-[(2-hydroxy-2-phenylethyl)amino]propan-2-ol is sourced from PubChem (CID 60710601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).