2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine

C11H18N4 — CID 21050456

IUPAC2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine
SMILESCN1CCC(Nc2ncccc2N)CC1
InChIInChI=1S/C11H18N4/c1-15-7-4-9(5-8-15)14-11-10(12)3-2-6-13-11/h2-3,6,9H,4-5,7-8,12H2,1H3,(H,13,14)
InChIKeyGDTAQBNDXYIEAO-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.17
Rot. Bonds2

About 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine

2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine (PubChem CID 21050456) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine
PubChem CID21050456
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine
SMILESCN1CCC(Nc2ncccc2N)CC1
InChIInChI=1S/C11H18N4/c1-15-7-4-9(5-8-15)14-11-10(12)3-2-6-13-11/h2-3,6,9H,4-5,7-8,12H2,1H3,(H,13,14)
InChIKeyGDTAQBNDXYIEAO-UHFFFAOYSA-N
XLogP1.17
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(oxan-4-yl)pyridine-2,3-diamine
CID 43609746
N-(1-methylpiperidin-4-yl)pyridin-2-amine;dihydrochloride
CID 174544706
3-[(1-methylpiperidin-4-yl)amino]pyrazine-2-carbothioamide
CID 55102703
2-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridine-2,3-diamine
CID 28818397
5-methoxy-N-(1-methylpiperidin-4-yl)isoquinolin-1-amine
CID 106537508
2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
CID 63278381
3-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine;3-phenylprop-2-ynal
CID 142989606
N-(1-methylazepan-4-yl)quinolin-5-amine
CID 65071582
8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine
CID 65070427
4-chloro-N-(1-methylpiperidin-4-yl)-1,5-naphthyridin-2-amine
CID 122154672
N-(1-methylpyrrolidin-3-yl)pyrimidin-2-amine
CID 61464985
4-N-(1-methylpyrrolidin-3-yl)quinoline-4,8-diamine
CID 83061261

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine?
The IUPAC name of 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine (CID 21050456) is 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine is CN1CCC(Nc2ncccc2N)CC1.
What is the InChIKey of 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine?
The InChIKey is GDTAQBNDXYIEAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-15-7-4-9(5-8-15)14-11-10(12)3-2-6-13-11/h2-3,6,9H,4-5,7-8,12H2,1H3,(H,13,14).
What are the key properties of 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine?
2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-methylpiperidin-4-yl)pyridine-2,3-diamine is sourced from PubChem (CID 21050456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).