2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine

C13H26N2 — CID 106316612

IUPAC2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine
SMILESCC1=CCCN(C(C)CNC(C)(C)C)C1
InChIInChI=1S/C13H26N2/c1-11-7-6-8-15(10-11)12(2)9-14-13(3,4)5/h7,12,14H,6,8-10H2,1-5H3
InChIKeyMZMZFVXSROHNAN-UHFFFAOYSA-N
MW210.37 g/mol
LogP2.41
Rot. Bonds3

About 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine

2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine (PubChem CID 106316612) has the molecular formula C13H26N2 and a molecular weight of 210.37 g/mol. Its IUPAC name is 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine
PubChem CID106316612
Molecular FormulaC13H26N2
Molecular Weight210.37 g/mol
Exact Mass210.21
IUPAC Name2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine
SMILESCC1=CCCN(C(C)CNC(C)(C)C)C1
InChIInChI=1S/C13H26N2/c1-11-7-6-8-15(10-11)12(2)9-14-13(3,4)5/h7,12,14H,6,8-10H2,1-5H3
InChIKeyMZMZFVXSROHNAN-UHFFFAOYSA-N
XLogP2.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine (CID 106316612) is 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine is CC1=CCCN(C(C)CNC(C)(C)C)C1.
What is the InChIKey of 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine?
The InChIKey is MZMZFVXSROHNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-7-6-8-15(10-11)12(2)9-14-13(3,4)5/h7,12,14H,6,8-10H2,1-5H3.
What are the key properties of 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine?
2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine has a molecular weight of 210.37 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)propyl]propan-2-amine is sourced from PubChem (CID 106316612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).