1-methyl-2-(4-methylpentyl)piperidine

C12H25N — CID 121009410

IUPAC1-methyl-2-(4-methylpentyl)piperidine
SMILESCC(C)CCCC1CCCCN1C
InChIInChI=1S/C12H25N/c1-11(2)7-6-9-12-8-4-5-10-13(12)3/h11-12H,4-10H2,1-3H3
InChIKeyTWEYUVAFVNYQHR-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.30
Rot. Bonds4

About 1-methyl-2-(4-methylpentyl)piperidine

1-methyl-2-(4-methylpentyl)piperidine (PubChem CID 121009410) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-methyl-2-(4-methylpentyl)piperidine.

Molecular Properties

Compound Name1-methyl-2-(4-methylpentyl)piperidine
PubChem CID121009410
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-methyl-2-(4-methylpentyl)piperidine
SMILESCC(C)CCCC1CCCCN1C
InChIInChI=1S/C12H25N/c1-11(2)7-6-9-12-8-4-5-10-13(12)3/h11-12H,4-10H2,1-3H3
InChIKeyTWEYUVAFVNYQHR-UHFFFAOYSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(4-methylpentyl)piperidine?
The IUPAC name of 1-methyl-2-(4-methylpentyl)piperidine (CID 121009410) is 1-methyl-2-(4-methylpentyl)piperidine.
What is the SMILES notation for 1-methyl-2-(4-methylpentyl)piperidine?
The canonical SMILES for 1-methyl-2-(4-methylpentyl)piperidine is CC(C)CCCC1CCCCN1C.
What is the InChIKey of 1-methyl-2-(4-methylpentyl)piperidine?
The InChIKey is TWEYUVAFVNYQHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-11(2)7-6-9-12-8-4-5-10-13(12)3/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-methyl-2-(4-methylpentyl)piperidine?
1-methyl-2-(4-methylpentyl)piperidine has a molecular weight of 183.34 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(4-methylpentyl)piperidine is sourced from PubChem (CID 121009410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).