N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine

C12H26N2 — CID 83043313

IUPACN-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine
SMILESCCCC(CNC)N1CCCCC1C
InChIInChI=1S/C12H26N2/c1-4-7-12(10-13-3)14-9-6-5-8-11(14)2/h11-13H,4-10H2,1-3H3
InChIKeyIZVGIOCDDNDAHL-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.25
Rot. Bonds5

About N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine

N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine (PubChem CID 83043313) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine
PubChem CID83043313
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine
SMILESCCCC(CNC)N1CCCCC1C
InChIInChI=1S/C12H26N2/c1-4-7-12(10-13-3)14-9-6-5-8-11(14)2/h11-13H,4-10H2,1-3H3
InChIKeyIZVGIOCDDNDAHL-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine (CID 83043313) is N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine is CCCC(CNC)N1CCCCC1C.
What is the InChIKey of N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine?
The InChIKey is IZVGIOCDDNDAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-7-12(10-13-3)14-9-6-5-8-11(14)2/h11-13H,4-10H2,1-3H3.
What are the key properties of N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine?
N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine has a molecular weight of 198.35 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 83043313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).