4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride

C19H26ClNO — CID 12944289

IUPAC4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride
SMILESCC(C)NCC(O)CCc1ccccc1-c1ccccc1.Cl
InChIInChI=1S/C19H25NO.ClH/c1-15(2)20-14-18(21)13-12-17-10-6-7-11-19(17)16-8-4-3-5-9-16;/h3-11,15,18,20-21H,12-14H2,1-2H3;1H
InChIKeyUDHWSNPUZBMNQX-UHFFFAOYSA-N
MW319.88 g/mol
LogP4.07
Rot. Bonds7

About 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride

4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride (PubChem CID 12944289) has the molecular formula C19H26ClNO and a molecular weight of 319.88 g/mol. Its IUPAC name is 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride.

Molecular Properties

Compound Name4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride
PubChem CID12944289
Molecular FormulaC19H26ClNO
Molecular Weight319.88 g/mol
Exact Mass319.17
IUPAC Name4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride
SMILESCC(C)NCC(O)CCc1ccccc1-c1ccccc1.Cl
InChIInChI=1S/C19H25NO.ClH/c1-15(2)20-14-18(21)13-12-17-10-6-7-11-19(17)16-8-4-3-5-9-16;/h3-11,15,18,20-21H,12-14H2,1-2H3;1H
InChIKeyUDHWSNPUZBMNQX-UHFFFAOYSA-N
XLogP4.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.88
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-phenylphenyl)ethyl]propan-2-amine
CID 144862405
4-(4-fluorophenyl)-1-(propan-2-ylamino)butan-2-ol
CID 112517961
2-iodo-4-(2-phenylphenyl)butanoic acid
CID 154425626
carbonic acid;1-(6-methylheptyl)-2-phenylbenzene
CID 159621881
1-phenyl-2-[3-(2-phenylphenyl)propyl]benzene
CID 57000067
1,5-diphenylpentan-3-ol;hydrochloride
CID 139805992
3-(2-phenylphenyl)propane-1,2-diol
CID 154118569
18-(2-phenylphenyl)-N-propan-2-yloctadecane-1-sulfonamide
CID 139664705
methanesulfonic acid;2-(2-phenylphenyl)ethanol
CID 87871544
(2R)-1-(9H-carbazol-4-yl)-3-(propan-2-ylamino)propan-2-ol
CID 102058988
N-[(2-phenylphenyl)methyl]butan-2-amine
CID 165473157
3-hydroxy-4-(2-phenylphenyl)butanoic acid
CID 53424527

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride?
The IUPAC name of 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride (CID 12944289) is 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride.
What is the SMILES notation for 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride?
The canonical SMILES for 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride is CC(C)NCC(O)CCc1ccccc1-c1ccccc1.Cl.
What is the InChIKey of 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride?
The InChIKey is UDHWSNPUZBMNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO.ClH/c1-15(2)20-14-18(21)13-12-17-10-6-7-11-19(17)16-8-4-3-5-9-16;/h3-11,15,18,20-21H,12-14H2,1-2H3;1H.
What are the key properties of 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride?
4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride has a molecular weight of 319.88 g/mol, XLogP of 4.07, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylphenyl)-1-(propan-2-ylamino)butan-2-ol;hydrochloride is sourced from PubChem (CID 12944289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).