N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine

C22H29N — CID 163675888

IUPACN-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
SMILESCc1cccc(N(C)c2ccc3c(c2)C(C)(C)CC3(C)C)c1C
InChIInChI=1S/C22H29N/c1-15-9-8-10-20(16(15)2)23(7)17-11-12-18-19(13-17)22(5,6)14-21(18,3)4/h8-13H,14H2,1-7H3
InChIKeyQZCSAAGVKYMXHN-UHFFFAOYSA-N
MW307.48 g/mol
LogP6.03
Rot. Bonds2

About N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine

N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine (PubChem CID 163675888) has the molecular formula C22H29N and a molecular weight of 307.48 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
PubChem CID163675888
Molecular FormulaC22H29N
Molecular Weight307.48 g/mol
Exact Mass307.23
IUPAC NameN-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
SMILESCc1cccc(N(C)c2ccc3c(c2)C(C)(C)CC3(C)C)c1C
InChIInChI=1S/C22H29N/c1-15-9-8-10-20(16(15)2)23(7)17-11-12-18-19(13-17)22(5,6)14-21(18,3)4/h8-13H,14H2,1-7H3
InChIKeyQZCSAAGVKYMXHN-UHFFFAOYSA-N
XLogP6.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500307.48
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-tert-butyl-2,6-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine
CID 163675892
N,1,1,3,3-pentamethyl-N-phenyl-2H-inden-4-amine
CID 163846154
N,9,9-trimethyl-N-(2-methylphenyl)fluoren-2-amine
CID 70891282
N-(2,4-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-4-amine
CID 163846157
N,2,3-trimethyl-N-silylaniline
CID 137327271
N-phenyl-N-[4-[4-(N-(1,1,3,3-tetramethyl-2H-inden-5-yl)anilino)phenyl]phenyl]naphthalen-1-amine
CID 170223047
N-(3-chloro-5-methylphenyl)-N,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-amine
CID 166879527
N,N-bis(3-phenylphenyl)-2-(1,1,3,3-tetramethyl-2H-inden-5-yl)aniline
CID 167260382
N-phenyl-N-[3-[4-[3-(4-phenyl-N-(1,1,3,3-tetramethyl-2H-inden-5-yl)anilino)phenyl]phenyl]phenyl]naphthalen-2-amine
CID 170223052
5,5,8,8-tetramethyl-N-(3-methylphenyl)-N-phenyl-6,7-dihydronaphthalen-2-amine
CID 142500873
N,5,5,8,8-pentamethyl-N-(2-methylphenyl)-6,7-dihydronaphthalen-1-amine
CID 163726619
N-(3-bromophenyl)-N,2-dimethylaniline
CID 146003911

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The IUPAC name of N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine (CID 163675888) is N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine.
What is the SMILES notation for N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The canonical SMILES for N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine is Cc1cccc(N(C)c2ccc3c(c2)C(C)(C)CC3(C)C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
The InChIKey is QZCSAAGVKYMXHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N/c1-15-9-8-10-20(16(15)2)23(7)17-11-12-18-19(13-17)22(5,6)14-21(18,3)4/h8-13H,14H2,1-7H3.
What are the key properties of N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine?
N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine has a molecular weight of 307.48 g/mol, XLogP of 6.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-N,1,1,3,3-pentamethyl-2H-inden-5-amine is sourced from PubChem (CID 163675888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).