[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride

C22H23ClN2O2 — CID 18615090

IUPAC[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride
SMILESCC(COc1ccc2c(c1)[nH]c1ccccc12)Nc1ccccc1CO.Cl
InChIInChI=1S/C22H22N2O2.ClH/c1-15(23-20-8-4-2-6-16(20)13-25)14-26-17-10-11-19-18-7-3-5-9-21(18)24-22(19)12-17;/h2-12,15,23-25H,13-14H2,1H3;1H
InChIKeyRKGMLANPMDGMHR-UHFFFAOYSA-N
MW382.89 g/mol
LogP5.11
Rot. Bonds6

About [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride

[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride (PubChem CID 18615090) has the molecular formula C22H23ClN2O2 and a molecular weight of 382.89 g/mol. Its IUPAC name is [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride.

Molecular Properties

Compound Name[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride
PubChem CID18615090
Molecular FormulaC22H23ClN2O2
Molecular Weight382.89 g/mol
Exact Mass382.14
IUPAC Name[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride
SMILESCC(COc1ccc2c(c1)[nH]c1ccccc12)Nc1ccccc1CO.Cl
InChIInChI=1S/C22H22N2O2.ClH/c1-15(23-20-8-4-2-6-16(20)13-25)14-26-17-10-11-19-18-7-3-5-9-21(18)24-22(19)12-17;/h2-12,15,23-25H,13-14H2,1H3;1H
InChIKeyRKGMLANPMDGMHR-UHFFFAOYSA-N
XLogP5.11
TPSA57.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.89
LogP ≤ 55.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride?
The IUPAC name of [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride (CID 18615090) is [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride.
What is the SMILES notation for [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride?
The canonical SMILES for [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride is CC(COc1ccc2c(c1)[nH]c1ccccc12)Nc1ccccc1CO.Cl.
What is the InChIKey of [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride?
The InChIKey is RKGMLANPMDGMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2.ClH/c1-15(23-20-8-4-2-6-16(20)13-25)14-26-17-10-11-19-18-7-3-5-9-21(18)24-22(19)12-17;/h2-12,15,23-25H,13-14H2,1H3;1H.
What are the key properties of [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride?
[2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride has a molecular weight of 382.89 g/mol, XLogP of 5.11, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-(9H-carbazol-2-yloxy)propan-2-ylamino]phenyl]methanol;hydrochloride is sourced from PubChem (CID 18615090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).