1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol

C22H23N3O2 — CID 70083257

IUPAC1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol
SMILESOC(CNCCc1ccccn1)COc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C22H23N3O2/c26-17(14-23-13-11-16-6-3-4-12-24-16)15-27-21-10-5-8-19-18-7-1-2-9-20(18)25-22(19)21/h1-10,12,17,23,25-26H,11,13-15H2
InChIKeyGXNNHTFEDZBEGE-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.29
Rot. Bonds8

About 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol

1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol (PubChem CID 70083257) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol.

Molecular Properties

Compound Name1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol
PubChem CID70083257
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol
SMILESOC(CNCCc1ccccn1)COc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C22H23N3O2/c26-17(14-23-13-11-16-6-3-4-12-24-16)15-27-21-10-5-8-19-18-7-1-2-9-20(18)25-22(19)21/h1-10,12,17,23,25-26H,11,13-15H2
InChIKeyGXNNHTFEDZBEGE-UHFFFAOYSA-N
XLogP3.29
TPSA70.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(4-chlorophenoxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol
CID 60635632
(2S)-3-(2-pyridin-2-ylethylamino)propane-1,2-diol
CID 61149855
(2R)-1-phenylmethoxy-3-(2-pyridin-2-ylethylamino)propan-2-ol
CID 140879411
1-(cyclopropylmethoxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol
CID 60635323
1-(2-methylphenoxy)-3-(pyridin-2-ylmethylamino)propan-2-ol
CID 60634071
1-(2,3-dichlorophenoxy)-3-(pyridin-2-ylmethylamino)propan-2-ol
CID 110906838
1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
CID 2585
1-[bis(2-pyridin-2-ylethyl)amino]-3-(2-pyridin-2-ylethylamino)propan-2-ol
CID 101479636
1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol;hydrochloride
CID 11419372
[1-(9H-carbazol-1-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-yl] benzoate
CID 70082649
methyl 4-hydroxy-5-(2-pyridin-2-ylethylamino)pentanoate
CID 115123641
1-cyclopentyl-3-(2-pyridin-2-ylethylamino)propan-2-ol
CID 103157099

Frequently Asked Questions

What is the IUPAC name of 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol?
The IUPAC name of 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol (CID 70083257) is 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol.
What is the SMILES notation for 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol?
The canonical SMILES for 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol is OC(CNCCc1ccccn1)COc1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol?
The InChIKey is GXNNHTFEDZBEGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c26-17(14-23-13-11-16-6-3-4-12-24-16)15-27-21-10-5-8-19-18-7-1-2-9-20(18)25-22(19)21/h1-10,12,17,23,25-26H,11,13-15H2.
What are the key properties of 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol?
1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol has a molecular weight of 361.45 g/mol, XLogP of 3.29, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-carbazol-1-yloxy)-3-(2-pyridin-2-ylethylamino)propan-2-ol is sourced from PubChem (CID 70083257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).