4-(4-methyl-1-phenylpentan-3-yl)pyridine

C17H21N — CID 19783307

IUPAC4-(4-methyl-1-phenylpentan-3-yl)pyridine
SMILESCC(C)C(CCc1ccccc1)c1ccncc1
InChIInChI=1S/C17H21N/c1-14(2)17(16-10-12-18-13-11-16)9-8-15-6-4-3-5-7-15/h3-7,10-14,17H,8-9H2,1-2H3
InChIKeyNHOLDGWSJGLEGD-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.45
Rot. Bonds5

About 4-(4-methyl-1-phenylpentan-3-yl)pyridine

4-(4-methyl-1-phenylpentan-3-yl)pyridine (PubChem CID 19783307) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-(4-methyl-1-phenylpentan-3-yl)pyridine.

Molecular Properties

Compound Name4-(4-methyl-1-phenylpentan-3-yl)pyridine
PubChem CID19783307
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name4-(4-methyl-1-phenylpentan-3-yl)pyridine
SMILESCC(C)C(CCc1ccccc1)c1ccncc1
InChIInChI=1S/C17H21N/c1-14(2)17(16-10-12-18-13-11-16)9-8-15-6-4-3-5-7-15/h3-7,10-14,17H,8-9H2,1-2H3
InChIKeyNHOLDGWSJGLEGD-UHFFFAOYSA-N
XLogP4.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-bromo-5-phenylpentan-2-yl)pyridine
CID 66452661
4-(7-phenylheptan-2-yl)pyridine
CID 14883828
3-methyl-2-phenyl-N-(2-pyridin-4-ylethyl)butan-1-amine
CID 107876015
3-methyl-2-(4-methyl-1-phenylpentan-3-yl)pyridine
CID 170263130
N-(4-phenylbutan-2-yl)pyridine-4-carboxamide
CID 3246771
3-phenyl-N-[(1R)-1-pyridin-4-ylethyl]propan-1-amine
CID 28646793
3-methyl-2-phenyl-N-[(1R)-1-pyridin-4-ylethyl]butan-1-amine
CID 107876315
4-phenyl-N-(pyridin-4-ylmethyl)butan-2-amine;hydrochloride
CID 17206485
bis[(3-phenyl-1-pyridin-4-ylpropyl)sulfanyl]methanethione
CID 58903320
4-phenyl-N-[(1S)-1-pyridin-3-ylethyl]butan-2-amine
CID 79690841
2-methyl-4-phenylbutane-1,1-diol
CID 20647936
[(3R)-3,4,4-trimethylpentyl]benzene
CID 101039673

Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-1-phenylpentan-3-yl)pyridine?
The IUPAC name of 4-(4-methyl-1-phenylpentan-3-yl)pyridine (CID 19783307) is 4-(4-methyl-1-phenylpentan-3-yl)pyridine.
What is the SMILES notation for 4-(4-methyl-1-phenylpentan-3-yl)pyridine?
The canonical SMILES for 4-(4-methyl-1-phenylpentan-3-yl)pyridine is CC(C)C(CCc1ccccc1)c1ccncc1.
What is the InChIKey of 4-(4-methyl-1-phenylpentan-3-yl)pyridine?
The InChIKey is NHOLDGWSJGLEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-14(2)17(16-10-12-18-13-11-16)9-8-15-6-4-3-5-7-15/h3-7,10-14,17H,8-9H2,1-2H3.
What are the key properties of 4-(4-methyl-1-phenylpentan-3-yl)pyridine?
4-(4-methyl-1-phenylpentan-3-yl)pyridine has a molecular weight of 239.36 g/mol, XLogP of 4.45, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-1-phenylpentan-3-yl)pyridine is sourced from PubChem (CID 19783307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).