2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine

C18H31N3 — CID 62285028

IUPAC2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC1CCN(c2cccc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C18H31N3/c1-5-7-15-10-12-21(13-11-15)17-9-6-8-16(20-17)14-19-18(2,3)4/h6,8-9,15,19H,5,7,10-14H2,1-4H3
InChIKeyPYDGVPDHXBJTMO-UHFFFAOYSA-N
MW289.47 g/mol
LogP3.99
Rot. Bonds5

About 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine

2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 62285028) has the molecular formula C18H31N3 and a molecular weight of 289.47 g/mol. Its IUPAC name is 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
PubChem CID62285028
Molecular FormulaC18H31N3
Molecular Weight289.47 g/mol
Exact Mass289.25
IUPAC Name2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
SMILESCCCC1CCN(c2cccc(CNC(C)(C)C)n2)CC1
InChIInChI=1S/C18H31N3/c1-5-7-15-10-12-21(13-11-15)17-9-6-8-16(20-17)14-19-18(2,3)4/h6,8-9,15,19H,5,7,10-14H2,1-4H3
InChIKeyPYDGVPDHXBJTMO-UHFFFAOYSA-N
XLogP3.99
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 ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[6-(3-methylpyrrolidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62284200
2-methyl-N-[[6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 83045593
2-methyl-N-[[6-(3-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62285603
2-fluoro-6-(4-propylpiperidin-1-yl)pyridine
CID 62205633
[6-(4-propylpiperidin-1-yl)-2-pyridinyl]hydrazine
CID 80908275
2-methyl-N-[[6-(3,3,4-trimethylpiperazin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 63619430
2-methyl-N-[2-(6-piperidin-1-yl-2-pyridinyl)ethyl]propan-2-amine
CID 155163774
N-[[6-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 114412857
2-methyl-N-[(6-pyrazol-1-yl-2-pyridinyl)methyl]propan-2-amine
CID 55059602
N-methyl-1-[6-(4-methylazepan-1-yl)-2-pyridinyl]methanamine
CID 63626658
N-[[6-(4-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62286089
N-[[6-[(3-ethylpiperidin-1-yl)methyl]-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106905911

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine (CID 62285028) is 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine is CCCC1CCN(c2cccc(CNC(C)(C)C)n2)CC1.
What is the InChIKey of 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is PYDGVPDHXBJTMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3/c1-5-7-15-10-12-21(13-11-15)17-9-6-8-16(20-17)14-19-18(2,3)4/h6,8-9,15,19H,5,7,10-14H2,1-4H3.
What are the key properties of 2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine?
2-methyl-N-[[6-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 289.47 g/mol, XLogP of 3.99, 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-(4-propylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62285028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).