1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride

C22H23ClN2O — CID 2864698

IUPAC1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride
SMILESCl.OC(CNCc1ccccc1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C22H22N2O.ClH/c25-18(15-23-14-17-8-2-1-3-9-17)16-24-21-12-6-4-10-19(21)20-11-5-7-13-22(20)24;/h1-13,18,23,25H,14-16H2;1H
InChIKeyYZKUUDPGZLZUQT-UHFFFAOYSA-N
MW366.89 g/mol
LogP4.37
Rot. Bonds6

About 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride

1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride (PubChem CID 2864698) has the molecular formula C22H23ClN2O and a molecular weight of 366.89 g/mol. Its IUPAC name is 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride.

Molecular Properties

Compound Name1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride
PubChem CID2864698
Molecular FormulaC22H23ClN2O
Molecular Weight366.89 g/mol
Exact Mass366.15
IUPAC Name1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride
SMILESCl.OC(CNCc1ccccc1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C22H22N2O.ClH/c25-18(15-23-14-17-8-2-1-3-9-17)16-24-21-12-6-4-10-19(21)20-11-5-7-13-22(20)24;/h1-13,18,23,25H,14-16H2;1H
InChIKeyYZKUUDPGZLZUQT-UHFFFAOYSA-N
XLogP4.37
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.89
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride?
The IUPAC name of 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride (CID 2864698) is 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride.
What is the SMILES notation for 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride?
The canonical SMILES for 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride is Cl.OC(CNCc1ccccc1)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride?
The InChIKey is YZKUUDPGZLZUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O.ClH/c25-18(15-23-14-17-8-2-1-3-9-17)16-24-21-12-6-4-10-19(21)20-11-5-7-13-22(20)24;/h1-13,18,23,25H,14-16H2;1H.
What are the key properties of 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride?
1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride has a molecular weight of 366.89 g/mol, XLogP of 4.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzylamino)-3-carbazol-9-ylpropan-2-ol;hydrochloride is sourced from PubChem (CID 2864698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).