9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate

C18H18N2O3 — CID 22905931

IUPAC9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate
SMILESCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O
InChIInChI=1S/C18H18N2O3/c1-11(17(19)21)20-18(22)23-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H2,19,21)(H,20,22)
InChIKeyDEWSWHGXEHLSKN-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.40
Rot. Bonds4

About 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate

9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate (PubChem CID 22905931) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate
PubChem CID22905931
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate
SMILESCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O
InChIInChI=1S/C18H18N2O3/c1-11(17(19)21)20-18(22)23-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H2,19,21)(H,20,22)
InChIKeyDEWSWHGXEHLSKN-UHFFFAOYSA-N
XLogP2.40
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid;hydrochloride
CID 77247911
(2S)-2-(9H-fluoren-9-ylmethoxycarbonyl(15N)amino)propanoic acid;hydrate
CID 45157536
9H-fluoren-9-ylmethyl N-[[(2S)-1-amino-1-oxopropan-2-yl]amino]carbamate
CID 143718810
9H-fluoren-9-ylmethyl N-[1-oxo-1-[[1-oxo-1-(3-oxobutan-2-ylamino)propan-2-yl]amino]propan-2-yl]carbamate
CID 58937812
9H-fluoren-9-ylmethyl N-[(2S)-1-hydroxypropan-2-yl]carbamate
CID 6924106
dimethyl (2R,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanedioate
CID 23651066
9H-fluoren-9-ylmethyl N-[1-[methoxy(methyl)amino]-1-oxopropan-2-yl]carbamate
CID 15549270
9H-fluoren-9-ylmethyl N-[(2R)-pentan-2-yl]carbamate
CID 142703958
9H-fluoren-9-ylmethyl N-(1-sulfanylpropan-2-yl)carbamate
CID 20732098
9H-fluoren-9-ylmethyl N-[(2R)-1-iodopropan-2-yl]carbamate
CID 101460179
2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoylamino]-3-methylbutanoic acid
CID 71343106
9H-fluoren-9-ylmethyl N-(1-methoxy-2-methylpropyl)carbamate
CID 102466963

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate (CID 22905931) is 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate is CC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(N)=O.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate?
The InChIKey is DEWSWHGXEHLSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-11(17(19)21)20-18(22)23-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H2,19,21)(H,20,22).
What are the key properties of 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate?
9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate has a molecular weight of 310.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-(1-amino-1-oxopropan-2-yl)carbamate is sourced from PubChem (CID 22905931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).