3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine

C18H17N3 — CID 70665226

IUPAC3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine
SMILESCNc1c(-c2cccc(-c3ccccc3)c2)ccnc1N
InChIInChI=1S/C18H17N3/c1-20-17-16(10-11-21-18(17)19)15-9-5-8-14(12-15)13-6-3-2-4-7-13/h2-12,20H,1H3,(H2,19,21)
InChIKeyDKYGMGVBNJOCHQ-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.04
Rot. Bonds3

About 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine

3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine (PubChem CID 70665226) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine
PubChem CID70665226
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine
SMILESCNc1c(-c2cccc(-c3ccccc3)c2)ccnc1N
InChIInChI=1S/C18H17N3/c1-20-17-16(10-11-21-18(17)19)15-9-5-8-14(12-15)13-6-3-2-4-7-13/h2-12,20H,1H3,(H2,19,21)
InChIKeyDKYGMGVBNJOCHQ-UHFFFAOYSA-N
XLogP4.04
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-methyl-4-(3-phenylphenyl)-2-pyridinyl]methanamine
CID 177019341
bis(1,3-diphenylbenzene);ethane
CID 144938975
3,4-dimethyl-2-(3-phenylphenyl)pyridine
CID 59594024
3-N-methyl-5-phenylpyridine-2,3-diamine
CID 4121982
4-phenyl-2-(3-phenylphenyl)pyridine
CID 58028222
[4-(3-phenylphenyl)-2-pyridinyl]methanamine
CID 177019282
4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 153434672
1,3-diphenylbenzene;ethane;methane
CID 171489435
2-methyl-1,3-bis(3-phenylphenyl)benzene
CID 162497496
1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 12623236
1,4-bis[3-(3-phenylphenyl)phenyl]benzene
CID 123341500
1-(3-phenylphenyl)-3,5-bis[3-(3-phenylphenyl)phenyl]benzene
CID 177124488

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine?
The IUPAC name of 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine (CID 70665226) is 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine.
What is the SMILES notation for 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine?
The canonical SMILES for 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine is CNc1c(-c2cccc(-c3ccccc3)c2)ccnc1N.
What is the InChIKey of 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine?
The InChIKey is DKYGMGVBNJOCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-20-17-16(10-11-21-18(17)19)15-9-5-8-14(12-15)13-6-3-2-4-7-13/h2-12,20H,1H3,(H2,19,21).
What are the key properties of 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine?
3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine has a molecular weight of 275.36 g/mol, XLogP of 4.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-4-(3-phenylphenyl)pyridine-2,3-diamine is sourced from PubChem (CID 70665226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).