9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone

C20H21NO2 — CID 91789060

IUPAC9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
SMILESCOCC1CCN(C(=O)C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C20H21NO2/c1-23-13-14-10-11-21(12-14)20(22)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19H,10-13H2,1H3
InChIKeyHWDONSOPEODIEB-UHFFFAOYSA-N
MW307.39 g/mol
LogP3.29
Rot. Bonds3

About 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone

9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone (PubChem CID 91789060) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
PubChem CID91789060
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
SMILESCOCC1CCN(C(=O)C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C20H21NO2/c1-23-13-14-10-11-21(12-14)20(22)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19H,10-13H2,1H3
InChIKeyHWDONSOPEODIEB-UHFFFAOYSA-N
XLogP3.29
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl 3-(methoxymethyl)pyrrolidine-1-carboxylate
CID 64591522
[(2S)-2,3-dihydro-1H-indol-2-yl]-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 64597075
9H-fluoren-9-ylmethyl 3-aminopyrrolidine-1-carboxylate
CID 2756439
2-chloro-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-phenylethanone
CID 64569488
cis-(1S,3R)-3-[3-(methoxymethyl)pyrrolidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114092440
2-[[3-(methoxymethyl)pyrrolidine-1-carbonyl]amino]benzoic acid
CID 64597013
3-(methoxymethyl)pyrrolidine-1-carboxylate
CID 131747487
(2-aminocyclopentyl)-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 64853017
9H-fluoren-9-ylmethyl 4-(hydroxymethyl)piperidine-1-carboxylate
CID 63310303
phenyl 4-(methoxymethyl)piperidine-1-carboxylate
CID 63999252
[4-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroisoquinolin-1-yl)methanone
CID 63978237
(2,3-dihydroxyphenyl)-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 114344445

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone?
The IUPAC name of 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone (CID 91789060) is 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone is COCC1CCN(C(=O)C2c3ccccc3-c3ccccc32)C1.
What is the InChIKey of 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone?
The InChIKey is HWDONSOPEODIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-23-13-14-10-11-21(12-14)20(22)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19H,10-13H2,1H3.
What are the key properties of 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone?
9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone has a molecular weight of 307.39 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-yl-[3-(methoxymethyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 91789060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).