N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine

C34H34N2 — CID 91379940

IUPACN-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine
SMILESCc1cccc(N(c2cccc(-c3cccc4ccccc34)n2)c2c(C(C)C)cccc2C(C)C)c1
InChIInChI=1S/C34H34N2/c1-23(2)28-17-10-18-29(24(3)4)34(28)36(27-15-8-12-25(5)22-27)33-21-11-20-32(35-33)31-19-9-14-26-13-6-7-16-30(26)31/h6-24H,1-5H3
InChIKeyVCDNBWDZTNSYFX-UHFFFAOYSA-N
MW470.66 g/mol
LogP9.93
Rot. Bonds6

About N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine

N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine (PubChem CID 91379940) has the molecular formula C34H34N2 and a molecular weight of 470.66 g/mol. Its IUPAC name is N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine.

Molecular Properties

Compound NameN-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine
PubChem CID91379940
Molecular FormulaC34H34N2
Molecular Weight470.66 g/mol
Exact Mass470.27
IUPAC NameN-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine
SMILESCc1cccc(N(c2cccc(-c3cccc4ccccc34)n2)c2c(C(C)C)cccc2C(C)C)c1
InChIInChI=1S/C34H34N2/c1-23(2)28-17-10-18-29(24(3)4)34(28)36(27-15-8-12-25(5)22-27)33-21-11-20-32(35-33)31-19-9-14-26-13-6-7-16-30(26)31/h6-24H,1-5H3
InChIKeyVCDNBWDZTNSYFX-UHFFFAOYSA-N
XLogP9.93
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.66
LogP ≤ 59.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2,6-di(propan-2-yl)phenyl]-6-naphthalen-1-ylpyridin-2-amine
CID 22292706
N,N-bis(3-methylphenyl)-1-naphthalen-1-ylnaphthalen-2-amine
CID 164774001
1-N,6-N-bis(3-methylphenyl)-1-N,6-N-dinaphthalen-1-yl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 143848120
9-N,9-N,10-N,10-N-tetrakis(3-methylphenyl)phenanthrene-9,10-diamine
CID 20734448
N-(3-methylphenyl)-N-phenylanthracen-9-amine
CID 22976643
N,N-bis(3-methylphenyl)chrysen-6-amine
CID 23520689
N-[2,6-di(propan-2-yl)phenyl]-1-(6-naphthalen-1-yl-2-pyridinyl)methanimine
CID 12070562
N-[3-[2-[2,6-di(propan-2-yl)phenyl]-1,2,4-triazol-3-yl]phenyl]-6-(2-methyl-[1]benzoselenolo[2,3-b]pyridin-8-yl)-N-phenylpyridin-2-amine
CID 140742224
4-methyl-2-naphthalen-1-ylpyridine
CID 13433020
3-methyl-N-(3-methylphenyl)-N-[4-[10-[4-[2-(4-naphthalen-1-ylnaphthalen-1-yl)ethenyl]naphthalen-1-yl]anthracen-9-yl]phenyl]aniline
CID 123173987
N-(3-methylphenyl)-N-phenanthren-3-ylphenanthren-2-amine
CID 140898025
5,6-dimethyl-2,9-dinaphthalen-1-yl-1,10-phenanthroline
CID 20596675

Frequently Asked Questions

What is the IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine?
The IUPAC name of N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine (CID 91379940) is N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine.
What is the SMILES notation for N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine?
The canonical SMILES for N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine is Cc1cccc(N(c2cccc(-c3cccc4ccccc34)n2)c2c(C(C)C)cccc2C(C)C)c1.
What is the InChIKey of N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine?
The InChIKey is VCDNBWDZTNSYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34N2/c1-23(2)28-17-10-18-29(24(3)4)34(28)36(27-15-8-12-25(5)22-27)33-21-11-20-32(35-33)31-19-9-14-26-13-6-7-16-30(26)31/h6-24H,1-5H3.
What are the key properties of N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine?
N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine has a molecular weight of 470.66 g/mol, XLogP of 9.93, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,6-di(propan-2-yl)phenyl]-N-(3-methylphenyl)-6-naphthalen-1-ylpyridin-2-amine is sourced from PubChem (CID 91379940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).