2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine

C16H27N3 — CID 83052021

IUPAC2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine
SMILESCCCC1CCCCN1C(CN)c1cnccc1C
InChIInChI=1S/C16H27N3/c1-3-6-14-7-4-5-10-19(14)16(11-17)15-12-18-9-8-13(15)2/h8-9,12,14,16H,3-7,10-11,17H2,1-2H3
InChIKeyYVUKBNUXNHFGOU-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.04
Rot. Bonds5

About 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine

2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine (PubChem CID 83052021) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine
PubChem CID83052021
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine
SMILESCCCC1CCCCN1C(CN)c1cnccc1C
InChIInChI=1S/C16H27N3/c1-3-6-14-7-4-5-10-19(14)16(11-17)15-12-18-9-8-13(15)2/h8-9,12,14,16H,3-7,10-11,17H2,1-2H3
InChIKeyYVUKBNUXNHFGOU-UHFFFAOYSA-N
XLogP3.04
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-cyclopropylphenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83053241
2-(3-bromo-4-methylphenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 105405159
2-(4-bromo-2-fluorophenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83052540
2-(2,6-difluorophenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83053654
2-(2-propylpiperidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571978
2-(2-ethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 43266319
2-(3,4-difluorophenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83053569
2-(2,5-dimethylphenyl)-2-(2-ethylpyrrolidin-1-yl)ethanamine
CID 54978141
2-(4-bromo-3-fluorophenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83052417
2-(2-ethylpiperidin-1-yl)-2-(3-propylimidazol-4-yl)ethanamine
CID 66130796
(2S)-2-phenyl-2-[(2S)-2-propylpiperidin-1-yl]ethanol
CID 10490739
2-(3,4-dimethylphenyl)-2-(2-ethylazepan-1-yl)ethanamine
CID 104689217

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine (CID 83052021) is 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine is CCCC1CCCCN1C(CN)c1cnccc1C.
What is the InChIKey of 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine?
The InChIKey is YVUKBNUXNHFGOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-3-6-14-7-4-5-10-19(14)16(11-17)15-12-18-9-8-13(15)2/h8-9,12,14,16H,3-7,10-11,17H2,1-2H3.
What are the key properties of 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine?
2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-3-pyridinyl)-2-(2-propylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 83052021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).