N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane

C12H26N2 — CID 171103601

IUPACN,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane
SMILESC/N=C1\CC(C)CCN1C(C)C.CC
InChIInChI=1S/C10H20N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h8-9H,5-7H2,1-4H3;1-2H3/b11-10+;
InChIKeyHKRLSQBXFKPGED-ASTDGNLGSA-N
MW198.35 g/mol
LogP3.18
Rot. Bonds1

About N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane

N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane (PubChem CID 171103601) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane.

Molecular Properties

Compound NameN,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane
PubChem CID171103601
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane
SMILESC/N=C1\CC(C)CCN1C(C)C.CC
InChIInChI=1S/C10H20N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h8-9H,5-7H2,1-4H3;1-2H3/b11-10+;
InChIKeyHKRLSQBXFKPGED-ASTDGNLGSA-N
XLogP3.18
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.18
H-Bond Donors ≤ 50
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 N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane?
The IUPAC name of N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane (CID 171103601) is N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane.
What is the SMILES notation for N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane?
The canonical SMILES for N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane is C/N=C1\CC(C)CCN1C(C)C.CC.
What is the InChIKey of N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane?
The InChIKey is HKRLSQBXFKPGED-ASTDGNLGSA-N. The full InChI is InChI=1S/C10H20N2.C2H6/c1-8(2)12-6-5-9(3)7-10(12)11-4;1-2/h8-9H,5-7H2,1-4H3;1-2H3/b11-10+;.
What are the key properties of N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane?
N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane has a molecular weight of 198.35 g/mol, XLogP of 3.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-propan-2-ylpiperidin-2-imine;ethane is sourced from PubChem (CID 171103601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).