N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine

C11H18N4 — CID 64928861

IUPACN-[(2-aminocyclohexyl)methyl]pyridazin-3-amine
SMILESNC1CCCCC1CNc1cccnn1
InChIInChI=1S/C11H18N4/c12-10-5-2-1-4-9(10)8-13-11-6-3-7-14-15-11/h3,6-7,9-10H,1-2,4-5,8,12H2,(H,13,15)
InChIKeyBISNCRVZFVAVHG-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.41
Rot. Bonds3

About N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine

N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine (PubChem CID 64928861) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[(2-aminocyclohexyl)methyl]pyridazin-3-amine
PubChem CID64928861
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-[(2-aminocyclohexyl)methyl]pyridazin-3-amine
SMILESNC1CCCCC1CNc1cccnn1
InChIInChI=1S/C11H18N4/c12-10-5-2-1-4-9(10)8-13-11-6-3-7-14-15-11/h3,6-7,9-10H,1-2,4-5,8,12H2,(H,13,15)
InChIKeyBISNCRVZFVAVHG-UHFFFAOYSA-N
XLogP1.41
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 ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine?
The IUPAC name of N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine (CID 64928861) is N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine.
What is the SMILES notation for N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine?
The canonical SMILES for N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine is NC1CCCCC1CNc1cccnn1.
What is the InChIKey of N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine?
The InChIKey is BISNCRVZFVAVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-10-5-2-1-4-9(10)8-13-11-6-3-7-14-15-11/h3,6-7,9-10H,1-2,4-5,8,12H2,(H,13,15).
What are the key properties of N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine?
N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine is sourced from PubChem (CID 64928861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).