9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine

C37H29N3 — CID 121465213

IUPAC9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
SMILESCn1c2cc(N(c3ccccc3)c3ccccc3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C37H29N3/c1-38-36-26-32(39(28-14-6-2-7-15-28)29-16-8-3-9-17-29)22-24-34(36)35-25-23-33(27-37(35)38)40(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-27H,1H3
InChIKeyYUWGVKQBBABGCU-UHFFFAOYSA-N
MW515.66 g/mol
LogP10.27
Rot. Bonds6

About 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine

9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine (PubChem CID 121465213) has the molecular formula C37H29N3 and a molecular weight of 515.66 g/mol. Its IUPAC name is 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine.

Molecular Properties

Compound Name9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
PubChem CID121465213
Molecular FormulaC37H29N3
Molecular Weight515.66 g/mol
Exact Mass515.24
IUPAC Name9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
SMILESCn1c2cc(N(c3ccccc3)c3ccccc3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C37H29N3/c1-38-36-26-32(39(28-14-6-2-7-15-28)29-16-8-3-9-17-29)22-24-34(36)35-25-23-33(27-37(35)38)40(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-27H,1H3
InChIKeyYUWGVKQBBABGCU-UHFFFAOYSA-N
XLogP10.27
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500515.66
LogP ≤ 510.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(5-methylbenzo[b]carbazol-3-yl)phenyl]-N-phenylnaphthalen-2-amine
CID 126631424
6-(7-carbazol-9-yl-9-methylcarbazol-3-yl)-9-methyl-N,N-diphenylcarbazol-2-amine
CID 147602808
2-N-(4-fluorophenyl)-2-N,9-dimethyl-7-N-(4-phenoxyphenyl)-7-N-phenylcarbazole-2,7-diamine
CID 70868222
6-(3-benzylphenyl)-9-methyl-N,N-diphenylcarbazol-2-amine
CID 121465257
3-carbazol-9-yl-N-(3-carbazol-9-ylphenyl)-N-methylaniline;7-carbazol-9-yl-9-methyl-N,N-diphenylcarbazol-2-amine;1-N-(3-carbazol-9-ylphenyl)-1-N-methyl-3-N,3-N-diphenylbenzene-1,3-diamine;2,7-di(carbazol-9-yl)-9-methylcarbazole;9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
CID 159147766
6-N,21-N-bis(4-tert-butylphenyl)-3,24-dimethyl-6-N,21-N-diphenyl-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene-6,21-diamine
CID 59181739
N-[4-[4-(5-methylbenzo[b]carbazol-2-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 126631207
N-(9,9-dimethylfluoren-2-yl)-6-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9-methylcarbazol-3-yl]-9-methyl-N-phenylcarbazol-2-amine
CID 147401277
21-methyl-N-naphthalen-2-yl-N-phenyl-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-18-amine
CID 126631430
6-N,18-N-bis(9-methylcarbazol-3-yl)-6-N,18-N-diphenyl-3,15-dithiahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16(21),17,19,23-undecaene-6,18-diamine
CID 162475625
3-N-(9-ethylcarbazol-2-yl)-1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]benzene-1,3-diamine
CID 177275887
N-[4-(9-methylcarbazol-3-yl)phenyl]-N-phenylnaphthalen-2-amine
CID 126631436

Frequently Asked Questions

What is the IUPAC name of 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine?
The IUPAC name of 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine (CID 121465213) is 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine.
What is the SMILES notation for 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine?
The canonical SMILES for 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine is Cn1c2cc(N(c3ccccc3)c3ccccc3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine?
The InChIKey is YUWGVKQBBABGCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H29N3/c1-38-36-26-32(39(28-14-6-2-7-15-28)29-16-8-3-9-17-29)22-24-34(36)35-25-23-33(27-37(35)38)40(30-18-10-4-11-19-30)31-20-12-5-13-21-31/h2-27H,1H3.
What are the key properties of 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine?
9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine has a molecular weight of 515.66 g/mol, XLogP of 10.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine is sourced from PubChem (CID 121465213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).