[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid

C19H23N3O3 — CID 118415459

IUPAC[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid
SMILESC[C@H](CNC[C@H](O)Cn1c2ccccc2c2ccccc21)NC(=O)O
InChIInChI=1S/C19H23N3O3/c1-13(21-19(24)25)10-20-11-14(23)12-22-17-8-4-2-6-15(17)16-7-3-5-9-18(16)22/h2-9,13-14,20-21,23H,10-12H2,1H3,(H,24,25)/t13-,14+/m1/s1
InChIKeyIJTDXFQVCQYADQ-KGLIPLIRSA-N
MW341.41 g/mol
LogP2.40
Rot. Bonds7

About [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid

[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid (PubChem CID 118415459) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid.

Molecular Properties

Compound Name[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid
PubChem CID118415459
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid
SMILESC[C@H](CNC[C@H](O)Cn1c2ccccc2c2ccccc21)NC(=O)O
InChIInChI=1S/C19H23N3O3/c1-13(21-19(24)25)10-20-11-14(23)12-22-17-8-4-2-6-15(17)16-7-3-5-9-18(16)22/h2-9,13-14,20-21,23H,10-12H2,1H3,(H,24,25)/t13-,14+/m1/s1
InChIKeyIJTDXFQVCQYADQ-KGLIPLIRSA-N
XLogP2.40
TPSA86.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid with MolForge

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Related Compounds

tert-butyl N-[1-[(3-carbazol-9-yl-2-hydroxypropyl)amino]propan-2-yl]carbamate
CID 123173626
1-carbazol-9-yl-3-[3-(dimethylamino)propylamino]propan-2-ol;oxalic acid
CID 16807164
(2R)-1-carbazol-9-yl-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 2368013
1-carbazol-9-yl-3-(1-phenylethylamino)propan-2-ol
CID 3635355
tert-butyl N-[3-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]-2-methylpropylidene]carbamate
CID 149336404
(2S)-1-carbazol-9-yl-3-(2,4,6-trimethylanilino)propan-2-ol
CID 7721479
3-[(3-carbazol-9-yl-2-hydroxypropyl)amino]-2,3-dimethylbutan-2-ol
CID 154741332
(2S)-2-[[(2R)-3-carbazol-9-yl-2-hydroxypropyl]amino]butan-1-ol
CID 962217
2-[(3-carbazol-9-yl-2-hydroxypropyl)amino]butan-1-ol
CID 6710542
1-anilino-3-(2,3-dimethylindol-1-yl)propan-2-ol;oxalic acid
CID 2897460
1-(2,3-dimethylindol-1-yl)-3-(2-phenylethylamino)propan-2-ol
CID 3635534
(2R)-1-carbazol-9-yl-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 7411148

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid?
The IUPAC name of [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid (CID 118415459) is [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid.
What is the SMILES notation for [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid?
The canonical SMILES for [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid is C[C@H](CNC[C@H](O)Cn1c2ccccc2c2ccccc21)NC(=O)O.
What is the InChIKey of [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid?
The InChIKey is IJTDXFQVCQYADQ-KGLIPLIRSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13(21-19(24)25)10-20-11-14(23)12-22-17-8-4-2-6-15(17)16-7-3-5-9-18(16)22/h2-9,13-14,20-21,23H,10-12H2,1H3,(H,24,25)/t13-,14+/m1/s1.
What are the key properties of [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid?
[(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid has a molecular weight of 341.41 g/mol, XLogP of 2.40, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[[(2S)-3-carbazol-9-yl-2-hydroxypropyl]amino]propan-2-yl]carbamic acid is sourced from PubChem (CID 118415459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).