4-methyl-1-propylpiperidine

C9H19N — CID 4100429

IUPAC4-methyl-1-propylpiperidine
SMILESCCCN1CCC(C)CC1
InChIInChI=1S/C9H19N/c1-3-6-10-7-4-9(2)5-8-10/h9H,3-8H2,1-2H3
InChIKeyFOAQPTXFAULJNM-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.13
Rot. Bonds2

About 4-methyl-1-propylpiperidine

4-methyl-1-propylpiperidine (PubChem CID 4100429) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 4-methyl-1-propylpiperidine.

Molecular Properties

Compound Name4-methyl-1-propylpiperidine
PubChem CID4100429
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name4-methyl-1-propylpiperidine
SMILESCCCN1CCC(C)CC1
InChIInChI=1S/C9H19N/c1-3-6-10-7-4-9(2)5-8-10/h9H,3-8H2,1-2H3
InChIKeyFOAQPTXFAULJNM-UHFFFAOYSA-N
XLogP2.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-propylpiperidine?
The IUPAC name of 4-methyl-1-propylpiperidine (CID 4100429) is 4-methyl-1-propylpiperidine.
What is the SMILES notation for 4-methyl-1-propylpiperidine?
The canonical SMILES for 4-methyl-1-propylpiperidine is CCCN1CCC(C)CC1.
What is the InChIKey of 4-methyl-1-propylpiperidine?
The InChIKey is FOAQPTXFAULJNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-3-6-10-7-4-9(2)5-8-10/h9H,3-8H2,1-2H3.
What are the key properties of 4-methyl-1-propylpiperidine?
4-methyl-1-propylpiperidine has a molecular weight of 141.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-propylpiperidine is sourced from PubChem (CID 4100429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).