2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine

C12H23N — CID 130718623

IUPAC2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine
SMILESCC1CCN(CC2CC2C)C(C)C1
InChIInChI=1S/C12H23N/c1-9-4-5-13(11(3)6-9)8-12-7-10(12)2/h9-12H,4-8H2,1-3H3
InChIKeyWWLMRJHKJRMSMI-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.76
Rot. Bonds2

About 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine

2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine (PubChem CID 130718623) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine.

Molecular Properties

Compound Name2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine
PubChem CID130718623
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine
SMILESCC1CCN(CC2CC2C)C(C)C1
InChIInChI=1S/C12H23N/c1-9-4-5-13(11(3)6-9)8-12-7-10(12)2/h9-12H,4-8H2,1-3H3
InChIKeyWWLMRJHKJRMSMI-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Hexyl-4-methylpiperidine
CID 4525600
Cyclohexanemethylamine, N-cyclopropyl-N-methyl-
CID 202160
1,2,5-Trimethylpiperidine
CID 338922
(2S,4S)-1,2,4-trimethylpiperidine
CID 21627805
N-Methyl-N-(4-methylheptan-2-yl)cyclopropanamine
CID 27526
N-(1-Cyclohexylethyl)-N-methylcyclopropanamine
CID 202161
Piperidine, 1,2,4-trimethyl-
CID 21627804
Piperidine, 1,2,2,4-tetramethyl-
CID 23423757
1,2,4,6-Tetramethylpiperidine
CID 435108
1,2,4-Trimethylpiperidine
CID 14454419
1-Methyl-3-athyl-piperidin
CID 17764459
Piperidine, 1-(1-cyclopropylpentyl)-
CID 586753

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine?
The IUPAC name of 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine (CID 130718623) is 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine.
What is the SMILES notation for 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine?
The canonical SMILES for 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine is CC1CCN(CC2CC2C)C(C)C1.
What is the InChIKey of 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine?
The InChIKey is WWLMRJHKJRMSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-9-4-5-13(11(3)6-9)8-12-7-10(12)2/h9-12H,4-8H2,1-3H3.
What are the key properties of 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine?
2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine has a molecular weight of 181.32 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-[(2-methylcyclopropyl)methyl]piperidine is sourced from PubChem (CID 130718623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).