ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate

C18H19NO2 — CID 171213682

IUPACethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate
SMILESCCOC(=O)C[C@@H](N)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H19NO2/c1-2-21-18(20)11-17(19)13-7-8-16-14(10-13)9-12-5-3-4-6-15(12)16/h3-8,10,17H,2,9,11,19H2,1H3/t17-/m1/s1
InChIKeyMUNXWDVNEAYBCN-QGZVFWFLSA-N
MW281.36 g/mol
LogP3.21
Rot. Bonds4

About ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate

ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate (PubChem CID 171213682) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate.

Molecular Properties

Compound Nameethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate
PubChem CID171213682
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Nameethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate
SMILESCCOC(=O)C[C@@H](N)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C18H19NO2/c1-2-21-18(20)11-17(19)13-7-8-16-14(10-13)9-12-5-3-4-6-15(12)16/h3-8,10,17H,2,9,11,19H2,1H3/t17-/m1/s1
InChIKeyMUNXWDVNEAYBCN-QGZVFWFLSA-N
XLogP3.21
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-(9H-fluoren-2-yl)butan-1-amine
CID 171233264
2-ethylsulfinyl-1-(9H-fluoren-2-yl)ethanamine
CID 64653976
(1S)-1-(9H-fluoren-2-yl)-3,3-difluoropropan-1-amine
CID 171313299
ethyl 2-amino-3-(9H-fluoren-2-yl)propanoate;hydrochloride
CID 70243578
(1R,2S)-1-amino-1-(9H-fluoren-2-yl)butan-2-ol
CID 171265056
(1S,2R)-1-amino-1-(9H-fluoren-2-yl)butan-2-ol
CID 171270729
1-(9H-fluoren-2-yl)-2-propan-2-ylsulfanylethanamine
CID 64634231
ethyl (2E)-2-(9H-fluoren-2-ylmethylidene)butanoate
CID 124637634
(2S)-2-amino-2-(9H-fluoren-3-yl)ethanol
CID 66515165
ethyl (3S)-3-amino-3-(4-phenylphenyl)propanoate
CID 29059678
ethyl (3S)-3-amino-3-(3-phenylphenyl)propanoate
CID 140935655
(1S)-1-(9H-fluoren-2-yl)butane-1,4-diamine;hydrochloride
CID 171233257

Frequently Asked Questions

What is the IUPAC name of ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate?
The IUPAC name of ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate (CID 171213682) is ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate.
What is the SMILES notation for ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate?
The canonical SMILES for ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate is CCOC(=O)C[C@@H](N)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate?
The InChIKey is MUNXWDVNEAYBCN-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H19NO2/c1-2-21-18(20)11-17(19)13-7-8-16-14(10-13)9-12-5-3-4-6-15(12)16/h3-8,10,17H,2,9,11,19H2,1H3/t17-/m1/s1.
What are the key properties of ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate?
ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate has a molecular weight of 281.36 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (3R)-3-amino-3-(9H-fluoren-2-yl)propanoate is sourced from PubChem (CID 171213682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).