ethane;6-propan-2-ylpyridazin-3-amine

C9H17N3 — CID 156711595

IUPACethane;6-propan-2-ylpyridazin-3-amine
SMILESCC.CC(C)c1ccc(N)nn1
InChIInChI=1S/C7H11N3.C2H6/c1-5(2)6-3-4-7(8)10-9-6;1-2/h3-5H,1-2H3,(H2,8,10);1-2H3
InChIKeyNPHVQFCKTWKIHP-UHFFFAOYSA-N
MW167.26 g/mol
LogP2.21
Rot. Bonds1

About ethane;6-propan-2-ylpyridazin-3-amine

ethane;6-propan-2-ylpyridazin-3-amine (PubChem CID 156711595) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is ethane;6-propan-2-ylpyridazin-3-amine.

Molecular Properties

Compound Nameethane;6-propan-2-ylpyridazin-3-amine
PubChem CID156711595
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC Nameethane;6-propan-2-ylpyridazin-3-amine
SMILESCC.CC(C)c1ccc(N)nn1
InChIInChI=1S/C7H11N3.C2H6/c1-5(2)6-3-4-7(8)10-9-6;1-2/h3-5H,1-2H3,(H2,8,10);1-2H3
InChIKeyNPHVQFCKTWKIHP-UHFFFAOYSA-N
XLogP2.21
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;6-propan-2-ylpyridazin-3-amine?
The IUPAC name of ethane;6-propan-2-ylpyridazin-3-amine (CID 156711595) is ethane;6-propan-2-ylpyridazin-3-amine.
What is the SMILES notation for ethane;6-propan-2-ylpyridazin-3-amine?
The canonical SMILES for ethane;6-propan-2-ylpyridazin-3-amine is CC.CC(C)c1ccc(N)nn1.
What is the InChIKey of ethane;6-propan-2-ylpyridazin-3-amine?
The InChIKey is NPHVQFCKTWKIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3.C2H6/c1-5(2)6-3-4-7(8)10-9-6;1-2/h3-5H,1-2H3,(H2,8,10);1-2H3.
What are the key properties of ethane;6-propan-2-ylpyridazin-3-amine?
ethane;6-propan-2-ylpyridazin-3-amine has a molecular weight of 167.26 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-propan-2-ylpyridazin-3-amine is sourced from PubChem (CID 156711595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).