2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine

C33H26N2 — CID 143420435

IUPAC2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine
SMILESC=Cc1[nH]c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2c1/C=C\C
InChIInChI=1S/C33H26N2/c1-3-11-28-29-22-25(20-21-31(29)34-30(28)4-2)35(32-18-9-14-23-12-5-7-16-26(23)32)33-19-10-15-24-13-6-8-17-27(24)33/h3-22,34H,2H2,1H3/b11-3-
InChIKeyAXUAPVDPNGCTIM-JYOAFUTRSA-N
MW450.59 g/mol
LogP9.62
Rot. Bonds5

About 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine

2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine (PubChem CID 143420435) has the molecular formula C33H26N2 and a molecular weight of 450.59 g/mol. Its IUPAC name is 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine.

Molecular Properties

Compound Name2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine
PubChem CID143420435
Molecular FormulaC33H26N2
Molecular Weight450.59 g/mol
Exact Mass450.21
IUPAC Name2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine
SMILESC=Cc1[nH]c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2c1/C=C\C
InChIInChI=1S/C33H26N2/c1-3-11-28-29-22-25(20-21-31(29)34-30(28)4-2)35(32-18-9-14-23-12-5-7-16-26(23)32)33-19-10-15-24-13-6-8-17-27(24)33/h3-22,34H,2H2,1H3/b11-3-
InChIKeyAXUAPVDPNGCTIM-JYOAFUTRSA-N
XLogP9.62
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.59
LogP ≤ 59.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[3-[3-[3-(N-[3-methyl-2-[(Z)-prop-1-enyl]phenyl]anilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 145442192
N-[4-[4-(2-ethenyl-3-methyl-N-naphthalen-1-ylanilino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 143619876
3-N-[7-[[2-ethenyl-3-[(Z)-prop-1-enyl]-1-benzothiophen-6-yl]-naphthalen-1-ylamino]dibenzothiophen-3-yl]-7-N-naphthalen-1-yl-3-N,7-N-diphenyldibenzothiophene-3,7-diamine
CID 167295274
2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 159424391
ethene;2-ethenyl-3-[(Z)-prop-1-enyl]-1,10-dihydropyrrolo[2,3-a]carbazole;methane
CID 145126089
naphthalene;2-N,2-N,6-N,6-N-tetranaphthalen-1-ylnaphthalene-2,6-diamine
CID 161142905
N-(4-ethenylphenyl)-N-naphthalen-1-ylhexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1(14),2(7),3,5,8,10,12,15,17,19,21,23,25-tridecaen-4-amine
CID 144754323
N-[3-[2-ethenyl-3-[(Z)-prop-1-enyl]-1-benzothiophen-7-yl]phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine
CID 144660507
3-ethenyl-2-(ethylideneamino)-N,N-diphenyl-1H-indol-5-amine
CID 174036081
N-[9-ethenyl-10-[(Z)-prop-1-enyl]phenanthren-3-yl]-7,7-dimethyl-N-naphthalen-1-ylfluoreno[4,3-b][1]benzothiol-10-amine
CID 144660694
4-N-phenanthren-3-yl-4-N-(4-phenylphenyl)-3-[(Z)-prop-1-enyl]-1-benzofuran-2,4-diamine
CID 166861188
2-chloro-N-naphthalen-1-yl-N-phenyl-1H-indol-4-amine
CID 170936574

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine?
The IUPAC name of 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine (CID 143420435) is 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine.
What is the SMILES notation for 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine?
The canonical SMILES for 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine is C=Cc1[nH]c2ccc(N(c3cccc4ccccc34)c3cccc4ccccc34)cc2c1/C=C\C.
What is the InChIKey of 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine?
The InChIKey is AXUAPVDPNGCTIM-JYOAFUTRSA-N. The full InChI is InChI=1S/C33H26N2/c1-3-11-28-29-22-25(20-21-31(29)34-30(28)4-2)35(32-18-9-14-23-12-5-7-16-26(23)32)33-19-10-15-24-13-6-8-17-27(24)33/h3-22,34H,2H2,1H3/b11-3-.
What are the key properties of 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine?
2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine has a molecular weight of 450.59 g/mol, XLogP of 9.62, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-N,N-dinaphthalen-1-yl-3-[(Z)-prop-1-enyl]-1H-indol-5-amine is sourced from PubChem (CID 143420435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).