9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene

C30H31N — CID 143561149

IUPAC9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene
SMILESCCc1ccc(C)c(-c2ccccc2C)c1.CCn1c2ccccc2c2ccccc21
InChIInChI=1S/C16H18.C14H13N/c1-4-14-10-9-13(3)16(11-14)15-8-6-5-7-12(15)2;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h5-11H,4H2,1-3H3;3-10H,2H2,1H3
InChIKeyDCMQOEGPEQOFCK-UHFFFAOYSA-N
MW405.59 g/mol
LogP8.35
Rot. Bonds3

About 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene

9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene (PubChem CID 143561149) has the molecular formula C30H31N and a molecular weight of 405.59 g/mol. Its IUPAC name is 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene.

Molecular Properties

Compound Name9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene
PubChem CID143561149
Molecular FormulaC30H31N
Molecular Weight405.59 g/mol
Exact Mass405.25
IUPAC Name9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene
SMILESCCc1ccc(C)c(-c2ccccc2C)c1.CCn1c2ccccc2c2ccccc21
InChIInChI=1S/C16H18.C14H13N/c1-4-14-10-9-13(3)16(11-14)15-8-6-5-7-12(15)2;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h5-11H,4H2,1-3H3;3-10H,2H2,1H3
InChIKeyDCMQOEGPEQOFCK-UHFFFAOYSA-N
XLogP8.35
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.59
LogP ≤ 58.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-ethyl-3-[(4-methylnaphthalen-1-yl)methyl]carbazole
CID 153374745
9-ethylcarbazole;bis(3-ethyl-9H-fluorene);9-phenylcarbazole
CID 91120993
2-[5-(9-ethylcarbazol-3-yl)-2-methylphenyl]-N-methylaniline
CID 163739218
9-ethyl-3-[3-(2-methylphenyl)propyl]carbazole
CID 159633776
2,4-diethyl-1-(2-methylphenyl)benzene
CID 142070386
9-ethyl-2-methylcarbazole
CID 19788789
9-ethyl-3-[[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]carbazole
CID 2162936
N,N-bis[(9-ethylcarbazol-3-yl)methyl]ethanamine
CID 160567842
2-ethyl-9-methylcarbazole
CID 71038255
N-[(9-ethylcarbazol-3-yl)methyl]-1-(4-methylphenyl)methanamine;hydrochloride
CID 17332553
3,5-diethyl-4H-pyrazole;9-ethylcarbazole;9H-fluorene
CID 162241948
3-(9-ethylcarbazol-3-yl)propan-1-ol
CID 117386651

Frequently Asked Questions

What is the IUPAC name of 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene?
The IUPAC name of 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene (CID 143561149) is 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene.
What is the SMILES notation for 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene?
The canonical SMILES for 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene is CCc1ccc(C)c(-c2ccccc2C)c1.CCn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene?
The InChIKey is DCMQOEGPEQOFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18.C14H13N/c1-4-14-10-9-13(3)16(11-14)15-8-6-5-7-12(15)2;1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h5-11H,4H2,1-3H3;3-10H,2H2,1H3.
What are the key properties of 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene?
9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene has a molecular weight of 405.59 g/mol, XLogP of 8.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethylcarbazole;4-ethyl-1-methyl-2-(2-methylphenyl)benzene is sourced from PubChem (CID 143561149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).