4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine

C19H24N2 — CID 174908054

IUPAC4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine
SMILESCC(C)C1CCCN(c2ccc(-c3ccncc3)cc2)C1
InChIInChI=1S/C19H24N2/c1-15(2)18-4-3-13-21(14-18)19-7-5-16(6-8-19)17-9-11-20-12-10-17/h5-12,15,18H,3-4,13-14H2,1-2H3
InChIKeyDHRKKQPNNCEWPC-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.62
Rot. Bonds3

About 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine

4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine (PubChem CID 174908054) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine.

Molecular Properties

Compound Name4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine
PubChem CID174908054
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine
SMILESCC(C)C1CCCN(c2ccc(-c3ccncc3)cc2)C1
InChIInChI=1S/C19H24N2/c1-15(2)18-4-3-13-21(14-18)19-7-5-16(6-8-19)17-9-11-20-12-10-17/h5-12,15,18H,3-4,13-14H2,1-2H3
InChIKeyDHRKKQPNNCEWPC-UHFFFAOYSA-N
XLogP4.62
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-[4-(trifluoromethyl)phenyl]piperidin-3-yl]ethanamine
CID 55257621
methane;1-(3-methylphenyl)-3-propan-2-ylpiperidine;2-methyl-5-(3-propan-2-ylpiperidin-1-yl)pyridine;1-phenyl-3-propan-2-ylpiperidine
CID 167711692
(1S)-1-[4-(4-propan-2-ylazepan-1-yl)phenyl]ethanol
CID 78992796
4-(3-propan-2-ylpyrrolidin-1-yl)benzonitrile
CID 112698409
(1R)-1-[(3R)-1-(6-methyl-3-pyridinyl)piperidin-3-yl]ethanol
CID 166682628
4-(4-pyridin-4-ylphenyl)morpholine
CID 91005781
1-[1-[4-(difluoromethylsulfonyl)phenyl]piperidin-3-yl]ethanamine
CID 63852993
6-[3-amino-6-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyrazin-2-yl]-7-fluoro-3,4-dihydro-2H-isoquinolin-1-one
CID 166092998
4-(3-ethenylpyrrolidin-1-yl)pyridine
CID 70465053
N-methyl-1-[1-(4-methylsulfonylphenyl)piperidin-3-yl]ethanamine
CID 63854393
4-pyrrolidin-1-ylpyridine
CID 158456628
N-[(1-pyridin-4-ylpiperidin-3-yl)methyl]ethanamine
CID 62592344

Frequently Asked Questions

What is the IUPAC name of 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine?
The IUPAC name of 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine (CID 174908054) is 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine.
What is the SMILES notation for 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine?
The canonical SMILES for 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine is CC(C)C1CCCN(c2ccc(-c3ccncc3)cc2)C1.
What is the InChIKey of 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine?
The InChIKey is DHRKKQPNNCEWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-15(2)18-4-3-13-21(14-18)19-7-5-16(6-8-19)17-9-11-20-12-10-17/h5-12,15,18H,3-4,13-14H2,1-2H3.
What are the key properties of 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine?
4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine has a molecular weight of 280.42 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3-propan-2-ylpiperidin-1-yl)phenyl]pyridine is sourced from PubChem (CID 174908054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).