N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine

C34H34N2 — CID 67291050

IUPACN-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine
SMILESCC(C)c1cccc(C(C)C)c1N(Cc1ccccc1)c1ncccc1-c1ccc2ccccc2c1
InChIInChI=1S/C34H34N2/c1-24(2)30-16-10-17-31(25(3)4)33(30)36(23-26-12-6-5-7-13-26)34-32(18-11-21-35-34)29-20-19-27-14-8-9-15-28(27)22-29/h5-22,24-25H,23H2,1-4H3
InChIKeyLBAZUFDFVIMTBP-UHFFFAOYSA-N
MW470.66 g/mol
LogP9.49
Rot. Bonds7

About N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine

N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine (PubChem CID 67291050) has the molecular formula C34H34N2 and a molecular weight of 470.66 g/mol. Its IUPAC name is N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine.

Molecular Properties

Compound NameN-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine
PubChem CID67291050
Molecular FormulaC34H34N2
Molecular Weight470.66 g/mol
Exact Mass470.27
IUPAC NameN-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine
SMILESCC(C)c1cccc(C(C)C)c1N(Cc1ccccc1)c1ncccc1-c1ccc2ccccc2c1
InChIInChI=1S/C34H34N2/c1-24(2)30-16-10-17-31(25(3)4)33(30)36(23-26-12-6-5-7-13-26)34-32(18-11-21-35-34)29-20-19-27-14-8-9-15-28(27)22-29/h5-22,24-25H,23H2,1-4H3
InChIKeyLBAZUFDFVIMTBP-UHFFFAOYSA-N
XLogP9.49
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.66
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-6-(2-phenyl-3-propan-2-ylphenyl)naphthalene
CID 123434342
[3-[2-(dimethylamino)-3-pyridinyl]phenyl]methanol
CID 155912933
3-(3-phenylmethoxyphenyl)-2-propan-2-ylpyridine
CID 71204410
5-(6-naphthalen-1-ylnaphthalen-2-yl)-10-phenylbenzo[g]quinoline
CID 59183100
3-(9,10-dinaphthalen-2-ylanthracen-2-yl)-2-methylpyridine
CID 90361392
8-[3-(phenylsulfanylmethyl)phenyl]-6-propan-2-ylquinoline
CID 10215723
2-(5-chloro-2-propan-2-ylphenyl)naphthalene
CID 142314685
5,10-bis(6-naphthalen-1-ylnaphthalen-2-yl)benzo[g]quinoline
CID 59183508
6-phenyl-1-propan-2-ylnaphthalene
CID 176757319
2,4-dinaphthalen-2-yl-6-(6-naphthalen-1-ylnaphthalen-2-yl)-1,3,5-triazine
CID 164745897
6-[2-[1-[4-[(dimethylamino)methyl]phenyl]propan-2-yl]phenyl]naphthalen-2-ol;ethane
CID 91484121
N-[4-[2,6-di(propan-2-yl)phenyl]phenyl]-9-naphthalen-2-yldibenzofuran-2-amine
CID 176760069

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine?
The IUPAC name of N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine (CID 67291050) is N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine.
What is the SMILES notation for N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine?
The canonical SMILES for N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine is CC(C)c1cccc(C(C)C)c1N(Cc1ccccc1)c1ncccc1-c1ccc2ccccc2c1.
What is the InChIKey of N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine?
The InChIKey is LBAZUFDFVIMTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34N2/c1-24(2)30-16-10-17-31(25(3)4)33(30)36(23-26-12-6-5-7-13-26)34-32(18-11-21-35-34)29-20-19-27-14-8-9-15-28(27)22-29/h5-22,24-25H,23H2,1-4H3.
What are the key properties of N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine?
N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine has a molecular weight of 470.66 g/mol, XLogP of 9.49, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[2,6-di(propan-2-yl)phenyl]-3-naphthalen-2-ylpyridin-2-amine is sourced from PubChem (CID 67291050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).