9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate

C24H23NO4 — CID 57188934

IUPAC9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate
SMILESCOc1ccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)c(OC)c1
InChIInChI=1S/C24H23NO4/c1-27-17-12-11-16(23(13-17)28-2)14-25-24(26)29-15-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-13,22H,14-15H2,1-2H3,(H,25,26)
InChIKeyMKAIJNAFEKMBSZ-UHFFFAOYSA-N
MW389.45 g/mol
LogP4.74
Rot. Bonds6

About 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate

9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate (PubChem CID 57188934) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate
PubChem CID57188934
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate
SMILESCOc1ccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)c(OC)c1
InChIInChI=1S/C24H23NO4/c1-27-17-12-11-16(23(13-17)28-2)14-25-24(26)29-15-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-13,22H,14-15H2,1-2H3,(H,25,26)
InChIKeyMKAIJNAFEKMBSZ-UHFFFAOYSA-N
XLogP4.74
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,4-dimethoxyphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylpropanoic acid
CID 171703060
9H-fluoren-9-ylmethyl N-[[2-[3-(hydroxymethyl)phenyl]-5-methoxyphenyl]methyl]carbamate
CID 135353911
(2,4-dimethoxyphenyl)methyl (2S)-5-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoate
CID 67334763
4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-2-methoxybenzoic acid
CID 136547452
9H-fluoren-9-ylmethyl N-[[4-(5-amino-5-oxopentoxy)-2,6-dimethoxyphenyl]methyl]carbamate
CID 71171472
2-(2-fluorophenyl)ethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate
CID 6736700
(2,4-dimethoxyphenyl)methylurea
CID 53362457
2-[(2,4-dimethoxyphenyl)methyl-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoyl]amino]acetic acid
CID 127255452
2-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-3-(2,4,5-trimethoxyphenyl)propanoic acid
CID 155487047
9H-fluoren-9-ylmethyl N-[3-(2-chloro-4-methoxyphenyl)prop-2-enyl]carbamate
CID 169469405
N-[(2,4-dimethoxyphenyl)methyl]cyclopropanecarboxamide
CID 47161024
(2R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(4-methoxyphenyl)propanoic acid
CID 91810266

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate (CID 57188934) is 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate is COc1ccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)c(OC)c1.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate?
The InChIKey is MKAIJNAFEKMBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c1-27-17-12-11-16(23(13-17)28-2)14-25-24(26)29-15-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-13,22H,14-15H2,1-2H3,(H,25,26).
What are the key properties of 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate?
9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate has a molecular weight of 389.45 g/mol, XLogP of 4.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-[(2,4-dimethoxyphenyl)methyl]carbamate is sourced from PubChem (CID 57188934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).