1-methyl-3,4-dipropylpiperidin-2-imine

C12H24N2 — CID 156860951

IUPAC1-methyl-3,4-dipropylpiperidin-2-imine
SMILES[H]/N=C1/C(CCC)C(CCC)CCN1C
InChIInChI=1S/C12H24N2/c1-4-6-10-8-9-14(3)12(13)11(10)7-5-2/h10-11,13H,4-9H2,1-3H3/b13-12-
InChIKeyNWIAKQUWZYRUSV-SEYXRHQNSA-N
MW196.34 g/mol
LogP3.13
Rot. Bonds4

About 1-methyl-3,4-dipropylpiperidin-2-imine

1-methyl-3,4-dipropylpiperidin-2-imine (PubChem CID 156860951) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-methyl-3,4-dipropylpiperidin-2-imine.

Molecular Properties

Compound Name1-methyl-3,4-dipropylpiperidin-2-imine
PubChem CID156860951
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-methyl-3,4-dipropylpiperidin-2-imine
SMILES[H]/N=C1/C(CCC)C(CCC)CCN1C
InChIInChI=1S/C12H24N2/c1-4-6-10-8-9-14(3)12(13)11(10)7-5-2/h10-11,13H,4-9H2,1-3H3/b13-12-
InChIKeyNWIAKQUWZYRUSV-SEYXRHQNSA-N
XLogP3.13
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3,4-dipropylpiperidin-2-imine?
The IUPAC name of 1-methyl-3,4-dipropylpiperidin-2-imine (CID 156860951) is 1-methyl-3,4-dipropylpiperidin-2-imine.
What is the SMILES notation for 1-methyl-3,4-dipropylpiperidin-2-imine?
The canonical SMILES for 1-methyl-3,4-dipropylpiperidin-2-imine is [H]/N=C1/C(CCC)C(CCC)CCN1C.
What is the InChIKey of 1-methyl-3,4-dipropylpiperidin-2-imine?
The InChIKey is NWIAKQUWZYRUSV-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-6-10-8-9-14(3)12(13)11(10)7-5-2/h10-11,13H,4-9H2,1-3H3/b13-12-.
What are the key properties of 1-methyl-3,4-dipropylpiperidin-2-imine?
1-methyl-3,4-dipropylpiperidin-2-imine has a molecular weight of 196.34 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3,4-dipropylpiperidin-2-imine is sourced from PubChem (CID 156860951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).