3-(2-methylpiperidin-1-yl)propan-1-amine

C9H20N2 — CID 520211

IUPAC3-(2-methylpiperidin-1-yl)propan-1-amine
SMILESCC1CCCCN1CCCN
InChIInChI=1S/C9H20N2/c1-9-5-2-3-7-11(9)8-4-6-10/h9H,2-8,10H2,1H3
InChIKeyYYAYTNPNFKPFNG-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.21
Rot. Bonds3

About 3-(2-methylpiperidin-1-yl)propan-1-amine

3-(2-methylpiperidin-1-yl)propan-1-amine (PubChem CID 520211) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 3-(2-methylpiperidin-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2-methylpiperidin-1-yl)propan-1-amine
PubChem CID520211
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name3-(2-methylpiperidin-1-yl)propan-1-amine
SMILESCC1CCCCN1CCCN
InChIInChI=1S/C9H20N2/c1-9-5-2-3-7-11(9)8-4-6-10/h9H,2-8,10H2,1H3
InChIKeyYYAYTNPNFKPFNG-UHFFFAOYSA-N
XLogP1.21
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpiperidin-1-yl)propan-1-amine?
The IUPAC name of 3-(2-methylpiperidin-1-yl)propan-1-amine (CID 520211) is 3-(2-methylpiperidin-1-yl)propan-1-amine.
What is the SMILES notation for 3-(2-methylpiperidin-1-yl)propan-1-amine?
The canonical SMILES for 3-(2-methylpiperidin-1-yl)propan-1-amine is CC1CCCCN1CCCN.
What is the InChIKey of 3-(2-methylpiperidin-1-yl)propan-1-amine?
The InChIKey is YYAYTNPNFKPFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-9-5-2-3-7-11(9)8-4-6-10/h9H,2-8,10H2,1H3.
What are the key properties of 3-(2-methylpiperidin-1-yl)propan-1-amine?
3-(2-methylpiperidin-1-yl)propan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpiperidin-1-yl)propan-1-amine is sourced from PubChem (CID 520211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).