N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine

C22H21NO — CID 2517460

IUPACN-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine
SMILESCOc1ccc(CN(C)C2c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C22H21NO/c1-23(15-16-11-13-17(24-2)14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14,22H,15H2,1-2H3
InChIKeyXTWWYLPZORXWTF-UHFFFAOYSA-N
MW315.42 g/mol
LogP4.90
Rot. Bonds4

About N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine

N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine (PubChem CID 2517460) has the molecular formula C22H21NO and a molecular weight of 315.42 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine
PubChem CID2517460
Molecular FormulaC22H21NO
Molecular Weight315.42 g/mol
Exact Mass315.16
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine
SMILESCOc1ccc(CN(C)C2c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C22H21NO/c1-23(15-16-11-13-17(24-2)14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14,22H,15H2,1-2H3
InChIKeyXTWWYLPZORXWTF-UHFFFAOYSA-N
XLogP4.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-methoxyphenyl)methyl]-N-methyl-1-(4-phenylphenyl)methanamine
CID 134791729
(9R,18S,27R)-9,18,27-tris[(4-methoxyphenyl)methyl]heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 100981985
3-methoxy-2-[(4-methoxyphenyl)methyl]-3H-isoindol-1-one
CID 3653878
9H-fluoren-9-ylmethyl (4-methoxyphenyl)methyl carbonate
CID 173166332
3-(N-benzyl-4-methoxyanilino)-3H-2-benzofuran-1-one
CID 19245192
1-N,1-N,4-N,4-N-tetrakis[(4-methoxyphenyl)methyl]benzene-1,4-diamine
CID 21254489
6-(4-methoxyphenyl)-6H-benzo[c]chromene
CID 86088499
N-butyl-N-methyl-9H-fluoren-9-amine
CID 14340271
N-[(4-methoxyphenyl)methyl]-N-methylpropan-1-amine
CID 122609914
[4-[[benzyl-[(4-methoxyphenyl)methyl]amino]methyl]phenyl]methanamine
CID 142934531
1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine
CID 22070460
1,1-dideuterio-N,N-bis[(4-methoxyphenyl)methyl]methanamine
CID 166042056

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine (CID 2517460) is N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine is COc1ccc(CN(C)C2c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine?
The InChIKey is XTWWYLPZORXWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO/c1-23(15-16-11-13-17(24-2)14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14,22H,15H2,1-2H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine?
N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine has a molecular weight of 315.42 g/mol, XLogP of 4.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-methyl-9H-fluoren-9-amine is sourced from PubChem (CID 2517460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).