N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine

C30H29N — CID 142541223

IUPACN-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine
SMILESC=CC1=C(C=C)C(C)(C)c2cc(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21
InChIInChI=1S/C30H29N/c1-7-21-23-15-13-19(17-27(23)29(3,4)25(21)8-2)31-20-14-16-24-22-11-9-10-12-26(22)30(5,6)28(24)18-20/h7-18,31H,1-2H2,3-6H3
InChIKeyYZARHRIQTVJFRL-UHFFFAOYSA-N
MW403.57 g/mol
LogP8.15
Rot. Bonds4

About N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine

N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine (PubChem CID 142541223) has the molecular formula C30H29N and a molecular weight of 403.57 g/mol. Its IUPAC name is N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine.

Molecular Properties

Compound NameN-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine
PubChem CID142541223
Molecular FormulaC30H29N
Molecular Weight403.57 g/mol
Exact Mass403.23
IUPAC NameN-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine
SMILESC=CC1=C(C=C)C(C)(C)c2cc(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21
InChIInChI=1S/C30H29N/c1-7-21-23-15-13-19(17-27(23)29(3,4)25(21)8-2)31-20-14-16-24-22-11-9-10-12-26(22)30(5,6)28(24)18-20/h7-18,31H,1-2H2,3-6H3
InChIKeyYZARHRIQTVJFRL-UHFFFAOYSA-N
XLogP8.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.57
LogP ≤ 58.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-ethenyl-3,3-dimethyl-2-[(Z)-prop-1-enyl]inden-5-yl]-9,9-dimethylfluoren-2-amine
CID 129111188
2,3-bis(ethenyl)-1,1-dimethylindene
CID 123900265
N-(4-ethenylphenyl)-9,9-dimethylfluoren-2-amine
CID 163509163
N-(9,9-dimethylfluoren-2-yl)-9,9,10,10-tetramethylanthracen-2-amine
CID 166647046
9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58453890
9,9-dimethyl-N-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 134528915
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160556555
3-N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-5-chloro-1-N,1-N,3-N-tris(9,9-dimethylfluoren-2-yl)benzene-1,3-diamine
CID 139541052
9,9-dimethyl-N-(4-trimethylsilylphenyl)fluoren-2-amine
CID 123399255
9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 59357506
N-[4-(4-fluorophenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 167260406
4-(9,9-dimethylfluoren-2-yl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]aniline;ethane
CID 143972766

Frequently Asked Questions

What is the IUPAC name of N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine?
The IUPAC name of N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine (CID 142541223) is N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine.
What is the SMILES notation for N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine?
The canonical SMILES for N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine is C=CC1=C(C=C)C(C)(C)c2cc(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21.
What is the InChIKey of N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine?
The InChIKey is YZARHRIQTVJFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N/c1-7-21-23-15-13-19(17-27(23)29(3,4)25(21)8-2)31-20-14-16-24-22-11-9-10-12-26(22)30(5,6)28(24)18-20/h7-18,31H,1-2H2,3-6H3.
What are the key properties of N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine?
N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine has a molecular weight of 403.57 g/mol, XLogP of 8.15, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1,2-bis(ethenyl)-3,3-dimethylinden-5-yl]-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 142541223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).