2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine

C18H31N3 — CID 83045593

IUPAC2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC1CCCCN1c1cccc(CNC(C)(C)C)n1
InChIInChI=1S/C18H31N3/c1-5-9-16-11-6-7-13-21(16)17-12-8-10-15(20-17)14-19-18(2,3)4/h8,10,12,16,19H,5-7,9,11,13-14H2,1-4H3
InChIKeyHVHOXPRGXMSXFP-UHFFFAOYSA-N
MW289.47 g/mol
LogP4.13
Rot. Bonds5

About 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 83045593) has the molecular formula C18H31N3 and a molecular weight of 289.47 g/mol. Its IUPAC name is 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
PubChem CID83045593
Molecular FormulaC18H31N3
Molecular Weight289.47 g/mol
Exact Mass289.25
IUPAC Name2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC1CCCCN1c1cccc(CNC(C)(C)C)n1
InChIInChI=1S/C18H31N3/c1-5-9-16-11-6-7-13-21(16)17-12-8-10-15(20-17)14-19-18(2,3)4/h8,10,12,16,19H,5-7,9,11,13-14H2,1-4H3
InChIKeyHVHOXPRGXMSXFP-UHFFFAOYSA-N
XLogP4.13
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.47
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285028
2-bromo-6-(2-propylpiperidin-1-yl)pyridine
CID 83056141
2-methyl-N-[[4-(2-propylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 83045363
N-[[6-(2-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 66458374
N-[[6-(2-ethylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62278840
N-[[6-(2-ethylpiperidin-1-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62279349
2-methyl-N-[[6-(3-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285603
2-methyl-N-[[6-(3-methylpyrrolidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62284200
2-methyl-N-[[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-2-amine
CID 83046678
2-(chloromethyl)-6-(2-propylpiperidin-1-yl)pyrazine
CID 83062274
N-[[5-(2-ethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107378795
N-[[6-(azocan-1-ylmethyl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106905667

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine (CID 83045593) is 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine is CCCC1CCCCN1c1cccc(CNC(C)(C)C)n1.
What is the InChIKey of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is HVHOXPRGXMSXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3/c1-5-9-16-11-6-7-13-21(16)17-12-8-10-15(20-17)14-19-18(2,3)4/h8,10,12,16,19H,5-7,9,11,13-14H2,1-4H3.
What are the key properties of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 289.47 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 83045593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).