(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride

C19H23ClN2O — CID 171264882

IUPAC(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride
SMILESCCn1c2ccccc2c2cc([C@@H](N)[C@@H](O)C3CC3)ccc21.Cl
InChIInChI=1S/C19H22N2O.ClH/c1-2-21-16-6-4-3-5-14(16)15-11-13(9-10-17(15)21)18(20)19(22)12-7-8-12;/h3-6,9-12,18-19,22H,2,7-8,20H2,1H3;1H/t18-,19+;/m1./s1
InChIKeyHKYRJYSBOFBCMW-VOMIJIAVSA-N
MW330.86 g/mol
LogP4.01
Rot. Bonds4

About (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride

(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride (PubChem CID 171264882) has the molecular formula C19H23ClN2O and a molecular weight of 330.86 g/mol. Its IUPAC name is (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride
PubChem CID171264882
Molecular FormulaC19H23ClN2O
Molecular Weight330.86 g/mol
Exact Mass330.15
IUPAC Name(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride
SMILESCCn1c2ccccc2c2cc([C@@H](N)[C@@H](O)C3CC3)ccc21.Cl
InChIInChI=1S/C19H22N2O.ClH/c1-2-21-16-6-4-3-5-14(16)15-11-13(9-10-17(15)21)18(20)19(22)12-7-8-12;/h3-6,9-12,18-19,22H,2,7-8,20H2,1H3;1H/t18-,19+;/m1./s1
InChIKeyHKYRJYSBOFBCMW-VOMIJIAVSA-N
XLogP4.01
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.86
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,2R)-2-amino-1-cyclopentyl-2-(9-ethylcarbazol-3-yl)ethanol
CID 171264885
(R)-cyclopropyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213067
(R)-cyclopentyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213069
(1R)-1-(9-ethylcarbazol-3-yl)-2-fluoroethanamine;hydrochloride
CID 171232651
(R)-(9-ethylcarbazol-3-yl)-(oxan-4-yl)methanamine
CID 171250725
2-(9-ethylcarbazol-3-yl)-2-hydroxyacetic acid
CID 117426376
3-amino-1-(9-ethylcarbazol-3-yl)propane-1,2-diol
CID 170829191
3-[(S)-cyclobutyl(piperazin-1-yl)methyl]-9-ethylcarbazole;dihydrochloride
CID 171282180
1-(9-ethylcarbazol-3-yl)propane-1,2,3-triol
CID 170819012
(1S)-1-(9-ethylcarbazol-3-yl)butane-1,4-diamine
CID 171232656
3-butan-2-yl-9-ethylcarbazole
CID 23520664
(3S)-3-amino-3-(9-ethylcarbazol-3-yl)propanenitrile
CID 171260153

Frequently Asked Questions

What is the IUPAC name of (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride?
The IUPAC name of (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride (CID 171264882) is (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride.
What is the SMILES notation for (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride?
The canonical SMILES for (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride is CCn1c2ccccc2c2cc([C@@H](N)[C@@H](O)C3CC3)ccc21.Cl.
What is the InChIKey of (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride?
The InChIKey is HKYRJYSBOFBCMW-VOMIJIAVSA-N. The full InChI is InChI=1S/C19H22N2O.ClH/c1-2-21-16-6-4-3-5-14(16)15-11-13(9-10-17(15)21)18(20)19(22)12-7-8-12;/h3-6,9-12,18-19,22H,2,7-8,20H2,1H3;1H/t18-,19+;/m1./s1.
What are the key properties of (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride?
(1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride has a molecular weight of 330.86 g/mol, XLogP of 4.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R)-2-amino-1-cyclopropyl-2-(9-ethylcarbazol-3-yl)ethanol;hydrochloride is sourced from PubChem (CID 171264882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).