3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine

C11H18N4 — CID 107415795

IUPAC3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine
SMILESCC1CCC(CNc2ccc(N)nn2)C1
InChIInChI=1S/C11H18N4/c1-8-2-3-9(6-8)7-13-11-5-4-10(12)14-15-11/h4-5,8-9H,2-3,6-7H2,1H3,(H2,12,14)(H,13,15)
InChIKeyNIFVZGCFIZUOTF-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.91
Rot. Bonds3

About 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine

3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine (PubChem CID 107415795) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine.

Molecular Properties

Compound Name3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine
PubChem CID107415795
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine
SMILESCC1CCC(CNc2ccc(N)nn2)C1
InChIInChI=1S/C11H18N4/c1-8-2-3-9(6-8)7-13-11-5-4-10(12)14-15-11/h4-5,8-9H,2-3,6-7H2,1H3,(H2,12,14)(H,13,15)
InChIKeyNIFVZGCFIZUOTF-UHFFFAOYSA-N
XLogP1.91
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-[(3-methylcyclopentyl)methyl]pyridazin-3-amine
CID 107414004
3-[[(6-aminopyridazin-3-yl)amino]methyl]cyclopentan-1-ol
CID 106137884
6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
CID 107416016
4-N-[(3-methylcyclopentyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 107415976
6-N-[(3-methylcyclopentyl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 107415860
4-methyl-N-[(3-methylcyclopentyl)methyl]pyridin-2-amine
CID 107413738
6-hydrazinyl-N-[(3-methylcyclopentyl)methyl]-2-methylsulfanylpyrimidin-4-amine
CID 107416021
2-chloro-N-[(3-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107414764
5-[(3-methylcyclopentyl)methylamino]pyrazine-2-carbonitrile
CID 107413331
6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine
CID 107415935
N-[(3-chlorocyclopentyl)methyl]-6-methylpyridazin-3-amine
CID 106124022
5,6-dimethyl-N-[(3-methylcyclopentyl)methyl]pyrazin-2-amine
CID 107414033

Frequently Asked Questions

What is the IUPAC name of 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine?
The IUPAC name of 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine (CID 107415795) is 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine.
What is the SMILES notation for 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine?
The canonical SMILES for 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine is CC1CCC(CNc2ccc(N)nn2)C1.
What is the InChIKey of 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine?
The InChIKey is NIFVZGCFIZUOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-8-2-3-9(6-8)7-13-11-5-4-10(12)14-15-11/h4-5,8-9H,2-3,6-7H2,1H3,(H2,12,14)(H,13,15).
What are the key properties of 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine?
3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[(3-methylcyclopentyl)methyl]pyridazine-3,6-diamine is sourced from PubChem (CID 107415795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).