6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine

C16H29N3 — CID 79481796

IUPAC6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(CC)CC(C)CC)n1
InChIInChI=1S/C16H29N3/c1-5-11-17-16-10-8-9-15(18-16)13-19(7-3)12-14(4)6-2/h8-10,14H,5-7,11-13H2,1-4H3,(H,17,18)
InChIKeyOXRGPIHPXXXYQZ-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.77
Rot. Bonds9

About 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine

6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine (PubChem CID 79481796) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
PubChem CID79481796
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
SMILESCCCNc1cccc(CN(CC)CC(C)CC)n1
InChIInChI=1S/C16H29N3/c1-5-11-17-16-10-8-9-15(18-16)13-19(7-3)12-14(4)6-2/h8-10,14H,5-7,11-13H2,1-4H3,(H,17,18)
InChIKeyOXRGPIHPXXXYQZ-UHFFFAOYSA-N
XLogP3.77
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[methyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243172
N-ethyl-N-[(6-hydrazinyl-2-pyridinyl)methyl]-2-methylbutan-1-amine
CID 79480473
6-[[benzyl(ethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79233870
6-[[methyl(pentan-3-yl)amino]methyl]-N-propylpyridin-2-amine
CID 79243531
2-[2,2-difluoroethyl-[[6-(propylamino)-2-pyridinyl]methyl]amino]ethanol
CID 107486212
2-[(2-amino-2-oxoethyl)-[[6-(propylamino)-2-pyridinyl]methyl]amino]acetamide
CID 79230668
3-[ethyl-[[6-(ethylamino)-2-pyridinyl]methyl]amino]-2-methylpropanenitrile
CID 79243747
6-[[methyl(1-methylsulfanylbutan-2-yl)amino]methyl]-N-propylpyridin-2-amine
CID 112664312
6-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]-N-propylpyridin-2-amine
CID 79234138
6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243725
6-[[methyl(2,2,2-trifluoroethyl)amino]methyl]-N-propylpyridin-2-amine
CID 79243620
6-(2-propan-2-yloxyethoxymethyl)-N-propylpyridin-2-amine
CID 79240041

Frequently Asked Questions

What is the IUPAC name of 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine?
The IUPAC name of 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine (CID 79481796) is 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine is CCCNc1cccc(CN(CC)CC(C)CC)n1.
What is the InChIKey of 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine?
The InChIKey is OXRGPIHPXXXYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-5-11-17-16-10-8-9-15(18-16)13-19(7-3)12-14(4)6-2/h8-10,14H,5-7,11-13H2,1-4H3,(H,17,18).
What are the key properties of 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine?
6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine has a molecular weight of 263.43 g/mol, XLogP of 3.77, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[ethyl(2-methylbutyl)amino]methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 79481796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).