2-phenyl-1-(1-phenylpropylamino)propan-2-ol

C18H23NO — CID 62374681

IUPAC2-phenyl-1-(1-phenylpropylamino)propan-2-ol
SMILESCCC(NCC(C)(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-3-17(15-10-6-4-7-11-15)19-14-18(2,20)16-12-8-5-9-13-16/h4-13,17,19-20H,3,14H2,1-2H3
InChIKeyPILCYALXQQTHSD-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.63
Rot. Bonds6

About 2-phenyl-1-(1-phenylpropylamino)propan-2-ol

2-phenyl-1-(1-phenylpropylamino)propan-2-ol (PubChem CID 62374681) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-phenyl-1-(1-phenylpropylamino)propan-2-ol.

Molecular Properties

Compound Name2-phenyl-1-(1-phenylpropylamino)propan-2-ol
PubChem CID62374681
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2-phenyl-1-(1-phenylpropylamino)propan-2-ol
SMILESCCC(NCC(C)(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-3-17(15-10-6-4-7-11-15)19-14-18(2,20)16-12-8-5-9-13-16/h4-13,17,19-20H,3,14H2,1-2H3
InChIKeyPILCYALXQQTHSD-UHFFFAOYSA-N
XLogP3.63
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-[[(1R)-1-phenylpropyl]amino]propan-2-ol
CID 94396195
2-phenyl-1-[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 63868258
methyl 2,2-dimethyl-3-(1-phenylpropylamino)propanoate
CID 79623966
N-[1-(4-chlorophenyl)propyl]-2-methyl-2-phenylpropan-1-amine
CID 63451971
4-methoxy-2,2-dimethyl-N-(1-phenylpropyl)butan-1-amine
CID 104624237
2-methyl-2-morpholin-4-yl-N-(1-phenylpropyl)propan-1-amine
CID 43202117
2-methyl-1-(1-phenylbutylamino)butan-2-ol
CID 65107747
1-(hexan-2-ylamino)-2-phenylpropan-2-ol
CID 62374352
1-(1-phenylpropylamino)butan-2-ol
CID 62305218
1-[(2-hydroxy-2-phenylethyl)amino]-2-phenylpropan-2-ol
CID 62375669
1-(1-methylsulfanylpropan-2-ylamino)-2-phenylpropan-2-ol
CID 115638973
2-methyl-1-[(2-methylsulfanyl-1-phenylethyl)amino]propan-2-ol
CID 111434426

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(1-phenylpropylamino)propan-2-ol?
The IUPAC name of 2-phenyl-1-(1-phenylpropylamino)propan-2-ol (CID 62374681) is 2-phenyl-1-(1-phenylpropylamino)propan-2-ol.
What is the SMILES notation for 2-phenyl-1-(1-phenylpropylamino)propan-2-ol?
The canonical SMILES for 2-phenyl-1-(1-phenylpropylamino)propan-2-ol is CCC(NCC(C)(O)c1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenyl-1-(1-phenylpropylamino)propan-2-ol?
The InChIKey is PILCYALXQQTHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-3-17(15-10-6-4-7-11-15)19-14-18(2,20)16-12-8-5-9-13-16/h4-13,17,19-20H,3,14H2,1-2H3.
What are the key properties of 2-phenyl-1-(1-phenylpropylamino)propan-2-ol?
2-phenyl-1-(1-phenylpropylamino)propan-2-ol has a molecular weight of 269.39 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(1-phenylpropylamino)propan-2-ol is sourced from PubChem (CID 62374681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).