2-amino-1,1,3-triphenylpropan-1-ol

C21H21NO — CID 4250937

IUPAC2-amino-1,1,3-triphenylpropan-1-ol
SMILESNC(Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21NO/c22-20(16-17-10-4-1-5-11-17)21(23,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20,23H,16,22H2
InChIKeyKBXBDYRXZGBOIH-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.49
Rot. Bonds5

About 2-amino-1,1,3-triphenylpropan-1-ol

2-amino-1,1,3-triphenylpropan-1-ol (PubChem CID 4250937) has the molecular formula C21H21NO and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-amino-1,1,3-triphenylpropan-1-ol.

Molecular Properties

Compound Name2-amino-1,1,3-triphenylpropan-1-ol
PubChem CID4250937
Molecular FormulaC21H21NO
Molecular Weight303.41 g/mol
Exact Mass303.16
IUPAC Name2-amino-1,1,3-triphenylpropan-1-ol
SMILESNC(Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21NO/c22-20(16-17-10-4-1-5-11-17)21(23,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20,23H,16,22H2
InChIKeyKBXBDYRXZGBOIH-UHFFFAOYSA-N
XLogP3.49
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1,1,3-triphenylpropan-1-ol?
The IUPAC name of 2-amino-1,1,3-triphenylpropan-1-ol (CID 4250937) is 2-amino-1,1,3-triphenylpropan-1-ol.
What is the SMILES notation for 2-amino-1,1,3-triphenylpropan-1-ol?
The canonical SMILES for 2-amino-1,1,3-triphenylpropan-1-ol is NC(Cc1ccccc1)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-amino-1,1,3-triphenylpropan-1-ol?
The InChIKey is KBXBDYRXZGBOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO/c22-20(16-17-10-4-1-5-11-17)21(23,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20,23H,16,22H2.
What are the key properties of 2-amino-1,1,3-triphenylpropan-1-ol?
2-amino-1,1,3-triphenylpropan-1-ol has a molecular weight of 303.41 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1,1,3-triphenylpropan-1-ol is sourced from PubChem (CID 4250937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).