1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine

C17H30N4 — CID 134574562

IUPAC1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine
SMILESCCN(CC)C(C)CNCc1cc(C)nc(N2CCC2)c1
InChIInChI=1S/C17H30N4/c1-5-20(6-2)15(4)12-18-13-16-10-14(3)19-17(11-16)21-8-7-9-21/h10-11,15,18H,5-9,12-13H2,1-4H3
InChIKeyUAACVTQQOKHWJQ-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.42
Rot. Bonds8

About 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine

1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine (PubChem CID 134574562) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine
PubChem CID134574562
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine
SMILESCCN(CC)C(C)CNCc1cc(C)nc(N2CCC2)c1
InChIInChI=1S/C17H30N4/c1-5-20(6-2)15(4)12-18-13-16-10-14(3)19-17(11-16)21-8-7-9-21/h10-11,15,18H,5-9,12-13H2,1-4H3
InChIKeyUAACVTQQOKHWJQ-UHFFFAOYSA-N
XLogP2.42
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine with MolForge

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Related Compounds

2-methyl-4-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine
CID 157425014
N-[[2-(3-methoxypyrrolidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 103539333
2-methyl-3-[methyl-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methylcarbamoyl]amino]propanoic acid
CID 122014778
[2-(azocan-1-yl)-6-methyl-4-pyridinyl]methanol
CID 113378723
6-methyl-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]pyridazin-3-amine
CID 155952533
2-methyl-N-[[2-methyl-6-(1,2,4-triazol-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 113379441
N-[[2-methyl-6-(3,4,5-trimethylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine
CID 114539964
5-methyl-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,3,4-oxadiazol-2-amine
CID 167810594
6-bromo-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]pyrazin-2-amine
CID 155951800
3-ethyl-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 155948841
3-methyl-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 155948830
1-[2-(azepan-1-yl)-6-ethyl-4-pyridinyl]-N-methylmethanamine
CID 113381283

Frequently Asked Questions

What is the IUPAC name of 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine?
The IUPAC name of 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine (CID 134574562) is 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine?
The canonical SMILES for 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine is CCN(CC)C(C)CNCc1cc(C)nc(N2CCC2)c1.
What is the InChIKey of 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine?
The InChIKey is UAACVTQQOKHWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-5-20(6-2)15(4)12-18-13-16-10-14(3)19-17(11-16)21-8-7-9-21/h10-11,15,18H,5-9,12-13H2,1-4H3.
What are the key properties of 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine?
1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine has a molecular weight of 290.45 g/mol, XLogP of 2.42, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[[2-(azetidin-1-yl)-6-methyl-4-pyridinyl]methyl]-2-N,2-N-diethylpropane-1,2-diamine is sourced from PubChem (CID 134574562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).