4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine

C15H26N2 — CID 62600384

IUPAC4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
SMILESCCCNC(Cc1ccccn1)CC(C)CC
InChIInChI=1S/C15H26N2/c1-4-9-16-15(11-13(3)5-2)12-14-8-6-7-10-17-14/h6-8,10,13,15-16H,4-5,9,11-12H2,1-3H3
InChIKeyQEILJOVNEXZIKI-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.43
Rot. Bonds8

About 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine

4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine (PubChem CID 62600384) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine.

Molecular Properties

Compound Name4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
PubChem CID62600384
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine
SMILESCCCNC(Cc1ccccn1)CC(C)CC
InChIInChI=1S/C15H26N2/c1-4-9-16-15(11-13(3)5-2)12-14-8-6-7-10-17-14/h6-8,10,13,15-16H,4-5,9,11-12H2,1-3H3
InChIKeyQEILJOVNEXZIKI-UHFFFAOYSA-N
XLogP3.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine?
The IUPAC name of 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine (CID 62600384) is 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine.
What is the SMILES notation for 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine?
The canonical SMILES for 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine is CCCNC(Cc1ccccn1)CC(C)CC.
What is the InChIKey of 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine?
The InChIKey is QEILJOVNEXZIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-9-16-15(11-13(3)5-2)12-14-8-6-7-10-17-14/h6-8,10,13,15-16H,4-5,9,11-12H2,1-3H3.
What are the key properties of 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine?
4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine has a molecular weight of 234.39 g/mol, XLogP of 3.43, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propyl-1-pyridin-2-ylhexan-2-amine is sourced from PubChem (CID 62600384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).