6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine

C13H23N3 — CID 61472487

IUPAC6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine
SMILESCc1ccc(NC(C)CCCC(C)C)nn1
InChIInChI=1S/C13H23N3/c1-10(2)6-5-7-11(3)14-13-9-8-12(4)15-16-13/h8-11H,5-7H2,1-4H3,(H,14,16)
InChIKeyANKGUDJGOBQSET-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.41
Rot. Bonds6

About 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine

6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine (PubChem CID 61472487) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine
PubChem CID61472487
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine
SMILESCc1ccc(NC(C)CCCC(C)C)nn1
InChIInChI=1S/C13H23N3/c1-10(2)6-5-7-11(3)14-13-9-8-12(4)15-16-13/h8-11H,5-7H2,1-4H3,(H,14,16)
InChIKeyANKGUDJGOBQSET-UHFFFAOYSA-N
XLogP3.41
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-pentan-2-ylpyridazin-3-amine
CID 61313507
N-methyl-6-(6-methylheptan-2-ylamino)pyridazine-3-carboxamide
CID 79207194
N-(6-methylheptan-2-yl)pyridin-2-amine
CID 61472531
6-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridazin-3-amine
CID 61474335
N-(6-methylheptan-2-yl)-5-(trifluoromethyl)pyridin-2-amine
CID 63539653
5,6-dimethyl-N-(6-methylheptan-2-yl)pyrazin-2-amine
CID 114475549
N-(6-methylheptan-2-yl)pyridin-4-amine
CID 61472376
2-N-ethyl-6-N-(6-methylheptan-2-yl)pyridine-2,6-diamine
CID 80800465
6-chloro-N-octan-2-ylpyridazin-3-amine
CID 61479963
6-methyl-N-[1-(4-methylphenyl)ethyl]pyridazin-3-amine
CID 54968124
N,6-dimethylpyridazin-3-amine;ethane
CID 156845540
4-N-(6-methylheptan-2-yl)benzene-1,4-diamine
CID 61469616

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine?
The IUPAC name of 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine (CID 61472487) is 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine.
What is the SMILES notation for 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine?
The canonical SMILES for 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine is Cc1ccc(NC(C)CCCC(C)C)nn1.
What is the InChIKey of 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine?
The InChIKey is ANKGUDJGOBQSET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10(2)6-5-7-11(3)14-13-9-8-12(4)15-16-13/h8-11H,5-7H2,1-4H3,(H,14,16).
What are the key properties of 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine?
6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine has a molecular weight of 221.35 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(6-methylheptan-2-yl)pyridazin-3-amine is sourced from PubChem (CID 61472487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).