9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate

C19H19NO4 — CID 130689635

IUPAC9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate
SMILESO=C(N[C@@H]1COC[C@H]1O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H19NO4/c21-18-11-23-10-17(18)20-19(22)24-9-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-18,21H,9-11H2,(H,20,22)/t17-,18-/m1/s1
InChIKeySAQSZNBNWRHPDN-QZTJIDSGSA-N
MW325.36 g/mol
LogP2.28
Rot. Bonds3

About 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate

9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate (PubChem CID 130689635) has the molecular formula C19H19NO4 and a molecular weight of 325.36 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate
PubChem CID130689635
Molecular FormulaC19H19NO4
Molecular Weight325.36 g/mol
Exact Mass325.13
IUPAC Name9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate
SMILESO=C(N[C@@H]1COC[C@H]1O)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C19H19NO4/c21-18-11-23-10-17(18)20-19(22)24-9-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-18,21H,9-11H2,(H,20,22)/t17-,18-/m1/s1
InChIKeySAQSZNBNWRHPDN-QZTJIDSGSA-N
XLogP2.28
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.36
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

9H-fluoren-9-ylmethyl N-(oxolan-3-yl)carbamate
CID 166803824
(1,3-dioxoisoindol-2-yl) (3S,4R)-4-(9H-fluoren-9-ylmethoxycarbonylamino)oxolane-3-carboxylate
CID 178193977
(1R,3S,4S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-hydroxycyclopentane-1-carboxylic acid
CID 11624815
9H-fluoren-9-ylmethyl N-(2-methylcyclohexyl)carbamate
CID 70659072
9H-fluoren-9-ylmethyl N-[(3S)-2-oxooxetan-3-yl]carbamate
CID 11130659
2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopentane-1-carboxylic acid
CID 4712584
cis-(1S,3R)-3-[[4-(9H-fluoren-9-ylmethoxycarbonylamino)oxolane-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 178198355
9H-fluoren-9-ylmethyl N-piperidin-4-ylcarbamate
CID 2756219
cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid
CID 91758019
cis-(1R,2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid;cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cycloheptane-1-carboxylic acid
CID 127239806
cis-(1S,2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexane-1-carboxylate
CID 86295180
9H-fluoren-9-ylmethyl N-[(3R)-2,5-dioxooxolan-3-yl]carbamate
CID 102482315

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate (CID 130689635) is 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate is O=C(N[C@@H]1COC[C@H]1O)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate?
The InChIKey is SAQSZNBNWRHPDN-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H19NO4/c21-18-11-23-10-17(18)20-19(22)24-9-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16-18,21H,9-11H2,(H,20,22)/t17-,18-/m1/s1.
What are the key properties of 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate?
9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate has a molecular weight of 325.36 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-[(3R,4S)-4-hydroxyoxolan-3-yl]carbamate is sourced from PubChem (CID 130689635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).