6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine

C17H23N3 — CID 106900926

IUPAC6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(NCc2ccc(CC)cc2)n1
InChIInChI=1S/C17H23N3/c1-3-12-18-16-6-5-7-17(20-16)19-13-15-10-8-14(4-2)9-11-15/h5-11H,3-4,12-13H2,1-2H3,(H2,18,19,20)
InChIKeyQAHYBSRKMMGSNL-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.08
Rot. Bonds7

About 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine

6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine (PubChem CID 106900926) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine
PubChem CID106900926
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine
SMILESCCCNc1cccc(NCc2ccc(CC)cc2)n1
InChIInChI=1S/C17H23N3/c1-3-12-18-16-6-5-7-17(20-16)19-13-15-10-8-14(4-2)9-11-15/h5-11H,3-4,12-13H2,1-2H3,(H2,18,19,20)
InChIKeyQAHYBSRKMMGSNL-UHFFFAOYSA-N
XLogP4.08
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-[(4-propan-2-ylphenyl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80793098
4-[[[6-(propylamino)-2-pyridinyl]amino]methyl]benzonitrile
CID 80821765
6-N-[(5-ethylthiophen-2-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 106015208
6-N-[(1-methylpyrazol-4-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80816894
6-N-[2-(4-fluorophenyl)ethyl]-2-N-propylpyridine-2,6-diamine
CID 80785034
6-N-[(4-bromophenyl)methyl]-2-N-ethylpyridine-2,6-diamine
CID 80755274
2-N-[(4-bromophenyl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80755206
6-N-[(2-methoxy-4-pyridinyl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80831001
6-N-[(5-methylthiophen-2-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80817701
6-N-pentan-3-yl-2-N-propylpyridine-2,6-diamine
CID 80770551
6-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 106378770
2-ethyl-4-N-[(4-fluorophenyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80939677

Frequently Asked Questions

What is the IUPAC name of 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine?
The IUPAC name of 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine (CID 106900926) is 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine?
The canonical SMILES for 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine is CCCNc1cccc(NCc2ccc(CC)cc2)n1.
What is the InChIKey of 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine?
The InChIKey is QAHYBSRKMMGSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-12-18-16-6-5-7-17(20-16)19-13-15-10-8-14(4-2)9-11-15/h5-11H,3-4,12-13H2,1-2H3,(H2,18,19,20).
What are the key properties of 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine?
6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine has a molecular weight of 269.39 g/mol, XLogP of 4.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[(4-ethylphenyl)methyl]-2-N-propylpyridine-2,6-diamine is sourced from PubChem (CID 106900926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).