6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine

C13H22N4 — CID 81132438

IUPAC6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine
SMILESCc1ccc(N)c(NCCN2CCCCC2)n1
InChIInChI=1S/C13H22N4/c1-11-5-6-12(14)13(16-11)15-7-10-17-8-3-2-4-9-17/h5-6H,2-4,7-10,14H2,1H3,(H,15,16)
InChIKeyKAMKAVGSWRMMRT-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.87
Rot. Bonds4

About 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine

6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine (PubChem CID 81132438) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine
PubChem CID81132438
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine
SMILESCc1ccc(N)c(NCCN2CCCCC2)n1
InChIInChI=1S/C13H22N4/c1-11-5-6-12(14)13(16-11)15-7-10-17-8-3-2-4-9-17/h5-6H,2-4,7-10,14H2,1H3,(H,15,16)
InChIKeyKAMKAVGSWRMMRT-UHFFFAOYSA-N
XLogP1.87
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-2-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2,3-diamine
CID 81131482
6-chloro-2-N-(2-pyrrolidin-1-ylethyl)pyridine-2,3-diamine
CID 24903988
2-[2-(azepan-1-yl)ethylamino]-4,6-dimethylpyridine-3-carbonitrile
CID 61240776
6-methyl-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 81131882
2-N-(cyclohexylmethyl)-6-methylpyridine-2,3-diamine
CID 81132071
1-N-[2-(azepan-1-yl)ethyl]-4-methylbenzene-1,3-diamine
CID 62911471
6-methyl-2-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,3-diamine
CID 81132211
4-N-[2-(azepan-1-yl)ethyl]benzene-1,2,4-triamine
CID 106750490
6-methyl-2-N-(3,3,3-trifluoropropyl)pyridine-2,3-diamine
CID 81132933
N-[2-(azepan-1-yl)ethyl]-3-methylpyrazin-2-amine
CID 83064744
2-N-[2-(azepan-1-yl)ethyl]-3-methylbenzene-1,2-diamine
CID 113333701
1-N-[2-(azepan-1-yl)ethyl]-4-methylbenzene-1,2-diamine
CID 61242311

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine?
The IUPAC name of 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine (CID 81132438) is 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine?
The canonical SMILES for 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine is Cc1ccc(N)c(NCCN2CCCCC2)n1.
What is the InChIKey of 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine?
The InChIKey is KAMKAVGSWRMMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-11-5-6-12(14)13(16-11)15-7-10-17-8-3-2-4-9-17/h5-6H,2-4,7-10,14H2,1H3,(H,15,16).
What are the key properties of 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine?
6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine has a molecular weight of 234.35 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N-(2-piperidin-1-ylethyl)pyridine-2,3-diamine is sourced from PubChem (CID 81132438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).