6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine

C14H18N6 — CID 175798659

IUPAC6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine
SMILESCN1CCC(c2ccc(Nc3ncccn3)nn2)CC1
InChIInChI=1S/C14H18N6/c1-20-9-5-11(6-10-20)12-3-4-13(19-18-12)17-14-15-7-2-8-16-14/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,15,16,17,19)
InChIKeyUEHMPWXTHQCQJN-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.82
Rot. Bonds3

About 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine

6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine (PubChem CID 175798659) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine
PubChem CID175798659
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine
SMILESCN1CCC(c2ccc(Nc3ncccn3)nn2)CC1
InChIInChI=1S/C14H18N6/c1-20-9-5-11(6-10-20)12-3-4-13(19-18-12)17-14-15-7-2-8-16-14/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,15,16,17,19)
InChIKeyUEHMPWXTHQCQJN-UHFFFAOYSA-N
XLogP1.82
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
CID 116973161
N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
CID 116973215
2-[5-fluoro-2-[[6-(1-methylpiperidin-4-yl)pyridazin-3-yl]amino]pyrimidin-4-yl]-3,5-dimethyl-7-propan-2-ylthieno[3,2-c]pyridin-4-one
CID 164709889
N,N'-dimethyl-N'-[6-(1-methylpiperidin-4-yl)pyridazin-3-yl]ethane-1,2-diamine
CID 116973312
3-(1-methylpyrrolidin-3-yl)pyridazine
CID 117105038
N-[(5-methylfuran-2-yl)methyl]-3-[[6-(1-methylpiperidin-4-yl)pyridazin-3-yl]amino]benzamide
CID 167404149
6-(1-benzylpiperidin-4-yl)-N-pyrimidin-2-ylpyrazin-2-amine
CID 155983124
2-methyl-6-(1-methylpiperidin-3-yl)-N-pyrimidin-2-ylpyrimidin-4-amine
CID 110255556
methyl-[6-(1-methylpiperidin-4-yl)pyridazin-3-yl]cyanamide
CID 116973853
N-[4-[1-[(3-methylimidazol-4-yl)methyl]piperidin-4-yl]-2-pyridinyl]pyrimidin-2-amine
CID 110097766
2,3-dichloro-6-(1-methylpiperidin-4-yl)pyridine
CID 138668007
6-(1-methylpiperidin-4-yl)pyridine-3-carbonitrile
CID 115022328

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine?
The IUPAC name of 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine (CID 175798659) is 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine.
What is the SMILES notation for 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine?
The canonical SMILES for 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine is CN1CCC(c2ccc(Nc3ncccn3)nn2)CC1.
What is the InChIKey of 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine?
The InChIKey is UEHMPWXTHQCQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-20-9-5-11(6-10-20)12-3-4-13(19-18-12)17-14-15-7-2-8-16-14/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,15,16,17,19).
What are the key properties of 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine?
6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine has a molecular weight of 270.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpiperidin-4-yl)-N-pyrimidin-2-ylpyridazin-3-amine is sourced from PubChem (CID 175798659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).