2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid

C20H21NO3 — CID 56913375

IUPAC2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid
SMILESO=C(O)CC1COCCN1Cc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C20H21NO3/c22-20(23)11-17-13-24-8-7-21(17)12-14-5-6-19-16(9-14)10-15-3-1-2-4-18(15)19/h1-6,9,17H,7-8,10-13H2,(H,22,23)
InChIKeyDIDALCKOZUAAQI-UHFFFAOYSA-N
MW323.39 g/mol
LogP2.93
Rot. Bonds4

About 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid

2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid (PubChem CID 56913375) has the molecular formula C20H21NO3 and a molecular weight of 323.39 g/mol. Its IUPAC name is 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid
PubChem CID56913375
Molecular FormulaC20H21NO3
Molecular Weight323.39 g/mol
Exact Mass323.15
IUPAC Name2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid
SMILESO=C(O)CC1COCCN1Cc1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C20H21NO3/c22-20(23)11-17-13-24-8-7-21(17)12-14-5-6-19-16(9-14)10-15-3-1-2-4-18(15)19/h1-6,9,17H,7-8,10-13H2,(H,22,23)
InChIKeyDIDALCKOZUAAQI-UHFFFAOYSA-N
XLogP2.93
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(2,2-dimethyl-3H-1-benzofuran-5-yl)methyl]morpholin-3-yl]acetic acid
CID 56904309
2-[(3R)-4-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]morpholin-3-yl]acetic acid
CID 95718552
2-[(3R)-4-[(2-pyrrolidin-1-ylpyrimidin-5-yl)methyl]morpholin-3-yl]acetic acid
CID 95726395
3-[4-[(4-methylphenyl)methyl]morpholin-3-yl]propanoic acid
CID 117009392
N-ethyl-2-[4-[(3-phenoxyphenyl)methyl]morpholin-3-yl]acetamide
CID 56897356
2-[(3R)-4-[[2-(2-phenylethoxy)phenyl]methyl]morpholin-3-yl]acetic acid
CID 95729743
2-[4-[[2-(2-phenylethoxy)phenyl]methyl]morpholin-3-yl]acetic acid
CID 56917100
2-[(3S)-4-[(1-methyl-2-oxoquinolin-3-yl)methyl]morpholin-3-yl]acetic acid
CID 95716426
[4-(2,3-dihydro-1H-inden-5-ylmethyl)morpholin-3-yl]methanamine
CID 83096056
(4-benzylmorpholin-3-yl)methylcarbamic acid
CID 21104643
2-[4-[(4-bromo-2-chlorophenyl)methyl]morpholin-3-yl]acetic acid
CID 113471103
2-[4-[(3-methylthiophen-2-yl)methyl]morpholin-3-yl]acetic acid
CID 74243764

Frequently Asked Questions

What is the IUPAC name of 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid?
The IUPAC name of 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid (CID 56913375) is 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid.
What is the SMILES notation for 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid?
The canonical SMILES for 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid is O=C(O)CC1COCCN1Cc1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid?
The InChIKey is DIDALCKOZUAAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO3/c22-20(23)11-17-13-24-8-7-21(17)12-14-5-6-19-16(9-14)10-15-3-1-2-4-18(15)19/h1-6,9,17H,7-8,10-13H2,(H,22,23).
What are the key properties of 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid?
2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid has a molecular weight of 323.39 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(9H-fluoren-2-ylmethyl)morpholin-3-yl]acetic acid is sourced from PubChem (CID 56913375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).