9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate

C23H20N2O2 — CID 169468939

IUPAC9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate
SMILESO=C(NCC=Cc1cccnc1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C23H20N2O2/c26-23(25-14-6-8-17-7-5-13-24-15-17)27-16-22-20-11-3-1-9-18(20)19-10-2-4-12-21(19)22/h1-13,15,22H,14,16H2,(H,25,26)
InChIKeyYVIXWIPCLHCDNC-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.63
Rot. Bonds5

About 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate

9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate (PubChem CID 169468939) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate
PubChem CID169468939
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate
SMILESO=C(NCC=Cc1cccnc1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C23H20N2O2/c26-23(25-14-6-8-17-7-5-13-24-15-17)27-16-22-20-11-3-1-9-18(20)19-10-2-4-12-21(19)22/h1-13,15,22H,14,16H2,(H,25,26)
InChIKeyYVIXWIPCLHCDNC-UHFFFAOYSA-N
XLogP4.63
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9H-fluoren-9-ylmethyl N-[3-(5-formyl-3-pyridinyl)prop-2-enyl]carbamate
CID 169469299
9H-fluoren-9-ylmethyl N-[3-(4-amino-3-pyridinyl)prop-2-enyl]carbamate
CID 169468973
9H-fluoren-9-ylmethyl N-(3-isoquinolin-6-ylprop-2-enyl)carbamate
CID 169469747
9H-fluoren-9-ylmethyl N-[3-(3-methyl-4-pyridinyl)prop-2-enyl]carbamate
CID 169469026
9H-fluoren-9-ylmethyl N-[3-(6-ethoxy-3-pyridinyl)prop-2-enyl]carbamate
CID 169469649
9H-fluoren-9-ylmethyl N-[3-(3,5-dibromo-4-pyridinyl)prop-2-enyl]carbamate
CID 169470944
9H-fluoren-9-ylmethyl N-[3-(2-methyl-4-pyridinyl)prop-2-enyl]carbamate
CID 169469022
9H-fluoren-9-ylmethyl N-[3-[4-(hydroxymethyl)phenyl]prop-2-enyl]carbamate
CID 169469145
9H-fluoren-9-ylmethyl N-[3-(4-amino-3,5-difluorophenyl)prop-2-enyl]carbamate
CID 169469613
9H-fluoren-9-ylmethyl N-[3-(4-imidazol-1-ylphenyl)prop-2-enyl]carbamate
CID 169470793
9H-fluoren-9-ylmethyl N-[3-(2-fluoro-3-pyridinyl)prop-2-enyl]carbamate
CID 169469006
9H-fluoren-9-ylmethyl N-[3-[3-(hydroxyiminomethyl)phenyl]prop-2-enyl]carbamate
CID 169469640

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate (CID 169468939) is 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate is O=C(NCC=Cc1cccnc1)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate?
The InChIKey is YVIXWIPCLHCDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c26-23(25-14-6-8-17-7-5-13-24-15-17)27-16-22-20-11-3-1-9-18(20)19-10-2-4-12-21(19)22/h1-13,15,22H,14,16H2,(H,25,26).
What are the key properties of 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate?
9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate has a molecular weight of 356.43 g/mol, XLogP of 4.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-(3-pyridin-3-ylprop-2-enyl)carbamate is sourced from PubChem (CID 169468939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).