4-methyl-1-(1-phenylpentyl)-4H-pyridine

C17H23N — CID 123709811

IUPAC4-methyl-1-(1-phenylpentyl)-4H-pyridine
SMILESCCCCC(c1ccccc1)N1C=CC(C)C=C1
InChIInChI=1S/C17H23N/c1-3-4-10-17(16-8-6-5-7-9-16)18-13-11-15(2)12-14-18/h5-9,11-15,17H,3-4,10H2,1-2H3
InChIKeyCNTFQZJMJXBSMJ-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.90
Rot. Bonds5

About 4-methyl-1-(1-phenylpentyl)-4H-pyridine

4-methyl-1-(1-phenylpentyl)-4H-pyridine (PubChem CID 123709811) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 4-methyl-1-(1-phenylpentyl)-4H-pyridine.

Molecular Properties

Compound Name4-methyl-1-(1-phenylpentyl)-4H-pyridine
PubChem CID123709811
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name4-methyl-1-(1-phenylpentyl)-4H-pyridine
SMILESCCCCC(c1ccccc1)N1C=CC(C)C=C1
InChIInChI=1S/C17H23N/c1-3-4-10-17(16-8-6-5-7-9-16)18-13-11-15(2)12-14-18/h5-9,11-15,17H,3-4,10H2,1-2H3
InChIKeyCNTFQZJMJXBSMJ-UHFFFAOYSA-N
XLogP4.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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heptan-3-ylbenzene;methane
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trimethyl-[(3R)-3-phenylhept-1-ynyl]silane
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N,N-dimethyl-1,3-diphenylheptan-1-amine
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N-(1-phenylethyl)hexan-2-amine
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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(1-phenylpentyl)-4H-pyridine?
The IUPAC name of 4-methyl-1-(1-phenylpentyl)-4H-pyridine (CID 123709811) is 4-methyl-1-(1-phenylpentyl)-4H-pyridine.
What is the SMILES notation for 4-methyl-1-(1-phenylpentyl)-4H-pyridine?
The canonical SMILES for 4-methyl-1-(1-phenylpentyl)-4H-pyridine is CCCCC(c1ccccc1)N1C=CC(C)C=C1.
What is the InChIKey of 4-methyl-1-(1-phenylpentyl)-4H-pyridine?
The InChIKey is CNTFQZJMJXBSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-3-4-10-17(16-8-6-5-7-9-16)18-13-11-15(2)12-14-18/h5-9,11-15,17H,3-4,10H2,1-2H3.
What are the key properties of 4-methyl-1-(1-phenylpentyl)-4H-pyridine?
4-methyl-1-(1-phenylpentyl)-4H-pyridine has a molecular weight of 241.38 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(1-phenylpentyl)-4H-pyridine is sourced from PubChem (CID 123709811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).