N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine

C40H26N2O — CID 163743576

IUPACN-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c3ccccc3cc3oc4ccccc4c23)cc1
InChIInChI=1S/C40H26N2O/c1-3-14-28(15-4-1)41(40-31-18-8-7-13-27(31)25-38-39(40)33-20-10-12-22-37(33)43-38)30-23-24-36-34(26-30)32-19-9-11-21-35(32)42(36)29-16-5-2-6-17-29/h1-26H
InChIKeyLJVYMWLDDXABRB-UHFFFAOYSA-N
MW550.66 g/mol
LogP11.31
Rot. Bonds4

About N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine

N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine (PubChem CID 163743576) has the molecular formula C40H26N2O and a molecular weight of 550.66 g/mol. Its IUPAC name is N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine.

Molecular Properties

Compound NameN-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine
PubChem CID163743576
Molecular FormulaC40H26N2O
Molecular Weight550.66 g/mol
Exact Mass550.20
IUPAC NameN-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine
SMILESc1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c3ccccc3cc3oc4ccccc4c23)cc1
InChIInChI=1S/C40H26N2O/c1-3-14-28(15-4-1)41(40-31-18-8-7-13-27(31)25-38-39(40)33-20-10-12-22-37(33)43-38)30-23-24-36-34(26-30)32-19-9-11-21-35(32)42(36)29-16-5-2-6-17-29/h1-26H
InChIKeyLJVYMWLDDXABRB-UHFFFAOYSA-N
XLogP11.31
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.66
LogP ≤ 511.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine with MolForge

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Related Compounds

N-naphtho[3,2-b][1]benzofuran-11-yl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-3-amine
CID 163568705
N-naphtho[3,2-b][1]benzofuran-11-yl-9-phenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]carbazol-2-amine
CID 163804566
N-dibenzofuran-1-yl-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 138717110
N-chrysen-2-yl-N-dibenzofuran-1-yl-9-phenylcarbazol-3-amine
CID 171399275
N-(4-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-9-phenyl-N-(3-phenylphenyl)carbazol-3-amine
CID 170033937
2-phenyl-N-(9-phenylcarbazol-3-yl)-N-(3-phenylphenyl)-[1]benzofuro[2,3-f][1,3]benzoxazol-4-amine
CID 167129379
N-[4-(9,21-dioxahexacyclo[11.11.0.02,10.03,8.014,22.015,20]tetracosa-1(13),2(10),3(8),4,6,11,14(22),15,17,19,23-undecaen-6-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 162697693
3-N-(10-oxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16(21),17,19-decaen-19-yl)-1-N-phenyl-3-N-(9-phenylcarbazol-3-yl)-1-N-(3-phenylphenyl)benzene-1,3-diamine
CID 170779241
8-N,23-N-diphenyl-8-N,23-N-bis(9-phenylcarbazol-3-yl)-13,18-dioxaheptacyclo[15.11.0.02,14.03,12.05,10.019,28.021,26]octacosa-1(17),2(14),3(12),4,6,8,10,15,19(28),20,22,24,26-tridecaene-8,23-diamine
CID 155362746
N-(10-oxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16(21),17,19-decaen-19-yl)-9-phenyl-N-(3-phenylphenyl)carbazol-3-amine
CID 170779636
2-N,2-N,6-N,6-N,9-N,9-N,10-N-heptakis-phenyl-10-N-(9-phenylcarbazol-3-yl)anthracene-2,6,9,10-tetramine
CID 172546753
N-naphtho[2,1-b][1]benzofuran-10-yl-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 163745971

Frequently Asked Questions

What is the IUPAC name of N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine?
The IUPAC name of N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine (CID 163743576) is N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine.
What is the SMILES notation for N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine?
The canonical SMILES for N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine is c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2c3ccccc3cc3oc4ccccc4c23)cc1.
What is the InChIKey of N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine?
The InChIKey is LJVYMWLDDXABRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26N2O/c1-3-14-28(15-4-1)41(40-31-18-8-7-13-27(31)25-38-39(40)33-20-10-12-22-37(33)43-38)30-23-24-36-34(26-30)32-19-9-11-21-35(32)42(36)29-16-5-2-6-17-29/h1-26H.
What are the key properties of N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine?
N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine has a molecular weight of 550.66 g/mol, XLogP of 11.31, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphtho[3,2-b][1]benzofuran-11-yl-N,9-diphenylcarbazol-3-amine is sourced from PubChem (CID 163743576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).