6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine

C11H18N4 — CID 145484790

IUPAC6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine
SMILESCc1cc(NC2CCNCC2)c(N)cn1
InChIInChI=1S/C11H18N4/c1-8-6-11(10(12)7-14-8)15-9-2-4-13-5-3-9/h6-7,9,13H,2-5,12H2,1H3,(H,14,15)
InChIKeyVJFRSGQHDQTVIF-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.14
Rot. Bonds2

About 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine

6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine (PubChem CID 145484790) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine.

Molecular Properties

Compound Name6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine
PubChem CID145484790
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine
SMILESCc1cc(NC2CCNCC2)c(N)cn1
InChIInChI=1S/C11H18N4/c1-8-6-11(10(12)7-14-8)15-9-2-4-13-5-3-9/h6-7,9,13H,2-5,12H2,1H3,(H,14,15)
InChIKeyVJFRSGQHDQTVIF-UHFFFAOYSA-N
XLogP1.14
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine?
The IUPAC name of 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine (CID 145484790) is 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine.
What is the SMILES notation for 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine?
The canonical SMILES for 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine is Cc1cc(NC2CCNCC2)c(N)cn1.
What is the InChIKey of 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine?
The InChIKey is VJFRSGQHDQTVIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-8-6-11(10(12)7-14-8)15-9-2-4-13-5-3-9/h6-7,9,13H,2-5,12H2,1H3,(H,14,15).
What are the key properties of 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine?
6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-N-piperidin-4-ylpyridine-3,4-diamine is sourced from PubChem (CID 145484790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).