6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine

C14H24N4 — CID 114086197

IUPAC6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine
SMILESCCC1CN(C)CCCN1c1ccc(N)c(C)n1
InChIInChI=1S/C14H24N4/c1-4-12-10-17(3)8-5-9-18(12)14-7-6-13(15)11(2)16-14/h6-7,12H,4-5,8-10,15H2,1-3H3
InChIKeyNGLWMTSVZDTMIZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.89
Rot. Bonds2

About 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine

6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine (PubChem CID 114086197) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine
PubChem CID114086197
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine
SMILESCCC1CN(C)CCCN1c1ccc(N)c(C)n1
InChIInChI=1S/C14H24N4/c1-4-12-10-17(3)8-5-9-18(12)14-7-6-13(15)11(2)16-14/h6-7,12H,4-5,8-10,15H2,1-3H3
InChIKeyNGLWMTSVZDTMIZ-UHFFFAOYSA-N
XLogP1.89
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)pyrimidin-2-amine
CID 114087642
2-(2-ethyl-4-methyl-1,4-diazepan-1-yl)aniline
CID 114086199
2-(2-ethyl-4-methyl-1,4-diazepan-1-yl)pyrimidin-4-amine
CID 114088533
6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-N'-hydroxypyridine-2-carboximidamide
CID 136726404
4-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-3-iodoaniline
CID 114086195
6-(2-ethylazepan-1-yl)-2-methoxypyridin-3-amine
CID 104688787
6-methyl-2-N-[2-(1-methylpiperidin-3-yl)ethyl]pyridine-2,5-diamine
CID 115147756
3-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-N'-hydroxypyridine-2-carboximidamide
CID 136726402
4-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-5-methoxy-1H-pyrimidin-6-one
CID 136726439
6-(3-methoxypiperidin-1-yl)-2-methylpyridin-3-amine
CID 102955729
1-[1-(5-amino-6-methyl-2-pyridinyl)pyrrolidin-3-yl]ethanol
CID 112624182
6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-ethoxypyridin-3-amine
CID 62885391

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine?
The IUPAC name of 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine (CID 114086197) is 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine.
What is the SMILES notation for 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine?
The canonical SMILES for 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine is CCC1CN(C)CCCN1c1ccc(N)c(C)n1.
What is the InChIKey of 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine?
The InChIKey is NGLWMTSVZDTMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-4-12-10-17(3)8-5-9-18(12)14-7-6-13(15)11(2)16-14/h6-7,12H,4-5,8-10,15H2,1-3H3.
What are the key properties of 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine?
6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethyl-4-methyl-1,4-diazepan-1-yl)-2-methylpyridin-3-amine is sourced from PubChem (CID 114086197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).