N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine

C32H21NO — CID 118616145

IUPACN-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc3cc(Nc4ccc5oc6ccc7ccccc7c6c5c4)ccc3c2)cc1
InChIInChI=1S/C32H21NO/c1-2-6-21(7-3-1)23-10-11-25-19-26(14-12-24(25)18-23)33-27-15-17-30-29(20-27)32-28-9-5-4-8-22(28)13-16-31(32)34-30/h1-20,33H
InChIKeyUESCABXICGJCBP-UHFFFAOYSA-N
MW435.53 g/mol
LogP9.30
Rot. Bonds3

About N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine

N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine (PubChem CID 118616145) has the molecular formula C32H21NO and a molecular weight of 435.53 g/mol. Its IUPAC name is N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine.

Molecular Properties

Compound NameN-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine
PubChem CID118616145
Molecular FormulaC32H21NO
Molecular Weight435.53 g/mol
Exact Mass435.16
IUPAC NameN-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine
SMILESc1ccc(-c2ccc3cc(Nc4ccc5oc6ccc7ccccc7c6c5c4)ccc3c2)cc1
InChIInChI=1S/C32H21NO/c1-2-6-21(7-3-1)23-10-11-25-19-26(14-12-24(25)18-23)33-27-15-17-30-29(20-27)32-28-9-5-4-8-22(28)13-16-31(32)34-30/h1-20,33H
InChIKeyUESCABXICGJCBP-UHFFFAOYSA-N
XLogP9.30
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.53
LogP ≤ 59.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-naphthalen-2-ylphenyl)-N-(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)-4-phenylaniline
CID 170031307
21-(6-phenylnaphthalen-2-yl)-14-oxaheptacyclo[15.12.0.03,15.04,13.05,10.018,23.024,29]nonacosa-1,3(15),4(13),5,7,9,11,16,18(23),19,21,24,26,28-tetradecaene
CID 149209334
10-[1,2,3,4,5,6,7,8-octadeuterio-10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 153473885
10-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 88568907
N-[6-(1-benzofuran-2-yl)naphthalen-2-yl]dibenzofuran-2-amine
CID 162366598
N,6-diphenylnaphthalen-2-amine
CID 67205043
2-[6-(9-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)naphthalen-2-yl]-8-phenyldibenzofuran
CID 58569882
2,8-bis(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran;2,8-bis(6-phenylnaphthalen-2-yl)dibenzofuran;2,8-bis(7-phenylnaphthalen-2-yl)dibenzofuran;2-[7-(cyclodecapentaenyl)naphthalen-2-yl]-8-(7-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran
CID 158865776
10-[6-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)naphthalen-2-yl]naphtho[2,1-b][1]benzofuran
CID 153473732
10-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 154595990
10-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;10-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;10-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;10-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran
CID 163827411
6,18-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene
CID 102362989

Frequently Asked Questions

What is the IUPAC name of N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine?
The IUPAC name of N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine (CID 118616145) is N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine.
What is the SMILES notation for N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine?
The canonical SMILES for N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine is c1ccc(-c2ccc3cc(Nc4ccc5oc6ccc7ccccc7c6c5c4)ccc3c2)cc1.
What is the InChIKey of N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine?
The InChIKey is UESCABXICGJCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21NO/c1-2-6-21(7-3-1)23-10-11-25-19-26(14-12-24(25)18-23)33-27-15-17-30-29(20-27)32-28-9-5-4-8-22(28)13-16-31(32)34-30/h1-20,33H.
What are the key properties of N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine?
N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine has a molecular weight of 435.53 g/mol, XLogP of 9.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenylnaphthalen-2-yl)naphtho[2,1-b][1]benzofuran-10-amine is sourced from PubChem (CID 118616145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).