9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate

C30H24N2O2 — CID 169470522

IUPAC9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate
SMILESO=C(NCC=Cc1ccc2[nH]c3ccccc3c2c1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C30H24N2O2/c33-30(34-19-27-23-11-3-1-9-21(23)22-10-2-4-12-24(22)27)31-17-7-8-20-15-16-29-26(18-20)25-13-5-6-14-28(25)32-29/h1-16,18,27,32H,17,19H2,(H,31,33)
InChIKeyWOLQJGXSLSJOPZ-UHFFFAOYSA-N
MW444.53 g/mol
LogP6.87
Rot. Bonds5

About 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate

9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate (PubChem CID 169470522) has the molecular formula C30H24N2O2 and a molecular weight of 444.53 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate
PubChem CID169470522
Molecular FormulaC30H24N2O2
Molecular Weight444.53 g/mol
Exact Mass444.18
IUPAC Name9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate
SMILESO=C(NCC=Cc1ccc2[nH]c3ccccc3c2c1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C30H24N2O2/c33-30(34-19-27-23-11-3-1-9-21(23)22-10-2-4-12-24(22)27)31-17-7-8-20-15-16-29-26(18-20)25-13-5-6-14-28(25)32-29/h1-16,18,27,32H,17,19H2,(H,31,33)
InChIKeyWOLQJGXSLSJOPZ-UHFFFAOYSA-N
XLogP6.87
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.53
LogP ≤ 56.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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4-[3-(9H-fluoren-9-ylmethoxycarbonylamino)prop-1-enyl]-2-methylbenzoic acid
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Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate (CID 169470522) is 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate is O=C(NCC=Cc1ccc2[nH]c3ccccc3c2c1)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate?
The InChIKey is WOLQJGXSLSJOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N2O2/c33-30(34-19-27-23-11-3-1-9-21(23)22-10-2-4-12-24(22)27)31-17-7-8-20-15-16-29-26(18-20)25-13-5-6-14-28(25)32-29/h1-16,18,27,32H,17,19H2,(H,31,33).
What are the key properties of 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate?
9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate has a molecular weight of 444.53 g/mol, XLogP of 6.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-[3-(9H-carbazol-3-yl)prop-2-enyl]carbamate is sourced from PubChem (CID 169470522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).