9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine

C30H28N2 — CID 168797319

IUPAC9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine
SMILESCCn1c2cc(C=C(C)C)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C30H28N2/c1-4-31-29-20-23(19-22(2)3)15-17-27(29)28-18-16-26(21-30(28)31)32(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-21H,4H2,1-3H3
InChIKeyPVIFERZBNVPBED-UHFFFAOYSA-N
MW416.57 g/mol
LogP8.71
Rot. Bonds5

About 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine

9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine (PubChem CID 168797319) has the molecular formula C30H28N2 and a molecular weight of 416.57 g/mol. Its IUPAC name is 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine.

Molecular Properties

Compound Name9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine
PubChem CID168797319
Molecular FormulaC30H28N2
Molecular Weight416.57 g/mol
Exact Mass416.23
IUPAC Name9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine
SMILESCCn1c2cc(C=C(C)C)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21
InChIInChI=1S/C30H28N2/c1-4-31-29-20-23(19-22(2)3)15-17-27(29)28-18-16-26(21-30(28)31)32(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-21H,4H2,1-3H3
InChIKeyPVIFERZBNVPBED-UHFFFAOYSA-N
XLogP8.71
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.57
LogP ≤ 58.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-N-(9-ethylcarbazol-2-yl)-1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]benzene-1,3-diamine
CID 177275887
23-ethyl-N,N-diphenyl-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8(13),9,11,15,17,19,21,24-dodecaen-10-amine
CID 89417765
9-ethyl-6-[2-[4-(N-phenylanilino)phenyl]ethenyl]carbazole-3-carbaldehyde
CID 156767860
9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
CID 121465213
2-[(9-ethylcarbazol-2-yl)methylidene]propanedinitrile
CID 88823200
23-ethyl-N,N-bis(4-phenylphenyl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8(13),9,11,15,17,19,21,24-dodecaen-10-amine
CID 86677000
9-[2-[3,6-bis[(9-ethylcarbazol-2-yl)-(9-ethylcarbazol-3-yl)amino]carbazol-9-yl]-3,4-dimethylcyclobutyl]-3-N,6-N-bis(9-ethylcarbazol-2-yl)-3-N,6-N-bis(9-ethylcarbazol-3-yl)carbazole-3,6-diamine
CID 168736679
[4-[bis(9-ethylcarbazol-3-yl)amino]phenyl]-phenylmethanone
CID 177399395
3-[(E)-2-[3,5-bis[(E)-2-(9-ethylcarbazol-3-yl)ethenyl]phenyl]ethenyl]-9-ethylcarbazole;3-N,6-N-bis(9-ethylcarbazol-3-yl)-3-N,6-N,9-triphenylcarbazole-3,6-diamine;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;bis(5,11-dinaphthalen-1-ylindolo[3,2-b]carbazole);4-N-(3-methylphenyl)-1-N,1-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 161262944
9-ethyl-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine;bis(9-methyl-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-amine)
CID 159037190
3-(9-ethylcarbazol-3-yl)-2-fluoroprop-2-enoic acid
CID 79736980
1-(9-ethylcarbazol-3-yl)-N-hydroxyprop-1-en-2-amine oxide
CID 163181667

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine?
The IUPAC name of 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine (CID 168797319) is 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine.
What is the SMILES notation for 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine?
The canonical SMILES for 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine is CCn1c2cc(C=C(C)C)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21.
What is the InChIKey of 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine?
The InChIKey is PVIFERZBNVPBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N2/c1-4-31-29-20-23(19-22(2)3)15-17-27(29)28-18-16-26(21-30(28)31)32(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-21H,4H2,1-3H3.
What are the key properties of 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine?
9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine has a molecular weight of 416.57 g/mol, XLogP of 8.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-7-(2-methylprop-1-enyl)-N,N-diphenylcarbazol-2-amine is sourced from PubChem (CID 168797319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).