1-(4-propan-2-ylpiperidin-1-yl)ethanimine

C10H20N2 — CID 103503769

IUPAC1-(4-propan-2-ylpiperidin-1-yl)ethanimine
SMILES[H]/N=C(\C)N1CCC(C(C)C)CC1
InChIInChI=1S/C10H20N2/c1-8(2)10-4-6-12(7-5-10)9(3)11/h8,10-11H,4-7H2,1-3H3/b11-9+
InChIKeyGYMVLYPCLRHJKZ-PKNBQFBNSA-N
MW168.28 g/mol
LogP2.35
Rot. Bonds1

About 1-(4-propan-2-ylpiperidin-1-yl)ethanimine

1-(4-propan-2-ylpiperidin-1-yl)ethanimine (PubChem CID 103503769) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(4-propan-2-ylpiperidin-1-yl)ethanimine.

Molecular Properties

Compound Name1-(4-propan-2-ylpiperidin-1-yl)ethanimine
PubChem CID103503769
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-(4-propan-2-ylpiperidin-1-yl)ethanimine
SMILES[H]/N=C(\C)N1CCC(C(C)C)CC1
InChIInChI=1S/C10H20N2/c1-8(2)10-4-6-12(7-5-10)9(3)11/h8,10-11H,4-7H2,1-3H3/b11-9+
InChIKeyGYMVLYPCLRHJKZ-PKNBQFBNSA-N
XLogP2.35
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4-propan-2-ylpiperidin-1-yl)ethanimine?
The IUPAC name of 1-(4-propan-2-ylpiperidin-1-yl)ethanimine (CID 103503769) is 1-(4-propan-2-ylpiperidin-1-yl)ethanimine.
What is the SMILES notation for 1-(4-propan-2-ylpiperidin-1-yl)ethanimine?
The canonical SMILES for 1-(4-propan-2-ylpiperidin-1-yl)ethanimine is [H]/N=C(\C)N1CCC(C(C)C)CC1.
What is the InChIKey of 1-(4-propan-2-ylpiperidin-1-yl)ethanimine?
The InChIKey is GYMVLYPCLRHJKZ-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H20N2/c1-8(2)10-4-6-12(7-5-10)9(3)11/h8,10-11H,4-7H2,1-3H3/b11-9+.
What are the key properties of 1-(4-propan-2-ylpiperidin-1-yl)ethanimine?
1-(4-propan-2-ylpiperidin-1-yl)ethanimine has a molecular weight of 168.28 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propan-2-ylpiperidin-1-yl)ethanimine is sourced from PubChem (CID 103503769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).