1,4-di(propan-2-yl)piperidine

C11H23N — CID 21303253

IUPAC1,4-di(propan-2-yl)piperidine
SMILESCC(C)C1CCN(C(C)C)CC1
InChIInChI=1S/C11H23N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3
InChIKeyCSMIWXJAUXGQCX-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.76
Rot. Bonds2

About 1,4-di(propan-2-yl)piperidine

1,4-di(propan-2-yl)piperidine (PubChem CID 21303253) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 1,4-di(propan-2-yl)piperidine.

Molecular Properties

Compound Name1,4-di(propan-2-yl)piperidine
PubChem CID21303253
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name1,4-di(propan-2-yl)piperidine
SMILESCC(C)C1CCN(C(C)C)CC1
InChIInChI=1S/C11H23N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3
InChIKeyCSMIWXJAUXGQCX-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

butane;1,4-di(propan-2-yl)piperazine;1,4-di(propan-2-yl)piperidine;ethane
CID 168928365
2,5-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;1,4-di(propan-2-yl)piperazine;bis(1,4-di(propan-2-yl)piperidine);methane
CID 159687749
4-(1-iodoethyl)-1-propan-2-ylpiperidine
CID 126675083
methane;1-(1-propan-2-ylpiperidin-4-yl)ethanamine
CID 158419714
3,8-di(propan-2-yl)-3,8-diazabicyclo[3.2.1]octane;1,4-di(propan-2-yl)piperazine;1,4-di(propan-2-yl)piperidine;methane
CID 159832079
1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 59059970
1,4-di(propan-2-yl)piperidine;2-methylpropylcyclohexane;propan-2-ylcyclohexane
CID 162072705
1-propan-2-yl-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine;1-propan-2-yl-4-[(4-propan-2-ylpiperidin-1-yl)methyl]piperidine
CID 167695333
ethane;propan-2-ylcyclohexane;1-propan-2-ylpiperidine
CID 159094239
4-cyclopropyl-1-propan-2-ylpiperidine
CID 70331530
1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine
CID 177123010
1-(1-propan-2-ylpiperidin-4-yl)ethane-1,2-diol
CID 117238997

Frequently Asked Questions

What is the IUPAC name of 1,4-di(propan-2-yl)piperidine?
The IUPAC name of 1,4-di(propan-2-yl)piperidine (CID 21303253) is 1,4-di(propan-2-yl)piperidine.
What is the SMILES notation for 1,4-di(propan-2-yl)piperidine?
The canonical SMILES for 1,4-di(propan-2-yl)piperidine is CC(C)C1CCN(C(C)C)CC1.
What is the InChIKey of 1,4-di(propan-2-yl)piperidine?
The InChIKey is CSMIWXJAUXGQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(2)11-5-7-12(8-6-11)10(3)4/h9-11H,5-8H2,1-4H3.
What are the key properties of 1,4-di(propan-2-yl)piperidine?
1,4-di(propan-2-yl)piperidine has a molecular weight of 169.31 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 1,4-di(propan-2-yl)piperidine is sourced from PubChem (CID 21303253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).