N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine

C30H22N4 — CID 58704350

IUPACN-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3cccc4ccccc34)c2)c2cccc(-n3cccn3)n2)cc1
InChIInChI=1S/C30H22N4/c1-2-13-25(14-3-1)34(30-19-8-18-29(32-30)33-21-9-20-31-33)26-15-6-12-24(22-26)28-17-7-11-23-10-4-5-16-27(23)28/h1-22H
InChIKeyZTLFDYHLVNCBTM-UHFFFAOYSA-N
MW438.53 g/mol
LogP7.56
Rot. Bonds5

About N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine

N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine (PubChem CID 58704350) has the molecular formula C30H22N4 and a molecular weight of 438.53 g/mol. Its IUPAC name is N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine.

Molecular Properties

Compound NameN-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine
PubChem CID58704350
Molecular FormulaC30H22N4
Molecular Weight438.53 g/mol
Exact Mass438.18
IUPAC NameN-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3cccc4ccccc34)c2)c2cccc(-n3cccn3)n2)cc1
InChIInChI=1S/C30H22N4/c1-2-13-25(14-3-1)34(30-19-8-18-29(32-30)33-21-9-20-31-33)26-15-6-12-24(22-26)28-17-7-11-23-10-4-5-16-27(23)28/h1-22H
InChIKeyZTLFDYHLVNCBTM-UHFFFAOYSA-N
XLogP7.56
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.53
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-6-pyrazol-1-yl-N-(3-thiophen-3-ylphenyl)pyridin-2-amine
CID 58704171
N-(3-naphthalen-1-ylphenyl)-N-phenyl-3-(3-phenylphenyl)aniline
CID 167323754
3-naphthalen-1-yl-N-(3-phenanthren-9-ylphenyl)-N-phenylaniline
CID 166566666
3-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]aniline
CID 172501995
3-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N-[4-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 168788673
N-(3-naphthalen-1-ylphenyl)-N,2-bis(3-phenylphenyl)aniline
CID 167324216
3-naphthalen-1-yl-N-(4-phenanthren-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167324009
3-(10-naphthalen-1-ylanthracen-9-yl)-N,N-diphenylaniline
CID 164717619
N-(4-naphthalen-1-ylphenyl)-3-phenanthren-9-yl-N-(3-phenanthren-9-ylphenyl)aniline
CID 162481190
N-(3-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 167324300
2,3,5,6-tetradeuterio-N-(3-naphthalen-1-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline
CID 171452136
N-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-2-[2-[2-(4-phenylphenyl)phenyl]phenyl]aniline
CID 172501525

Frequently Asked Questions

What is the IUPAC name of N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine?
The IUPAC name of N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine (CID 58704350) is N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine.
What is the SMILES notation for N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine?
The canonical SMILES for N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine is c1ccc(N(c2cccc(-c3cccc4ccccc34)c2)c2cccc(-n3cccn3)n2)cc1.
What is the InChIKey of N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine?
The InChIKey is ZTLFDYHLVNCBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N4/c1-2-13-25(14-3-1)34(30-19-8-18-29(32-30)33-21-9-20-31-33)26-15-6-12-24(22-26)28-17-7-11-23-10-4-5-16-27(23)28/h1-22H.
What are the key properties of N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine?
N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine has a molecular weight of 438.53 g/mol, XLogP of 7.56, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-naphthalen-1-ylphenyl)-N-phenyl-6-pyrazol-1-ylpyridin-2-amine is sourced from PubChem (CID 58704350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).