1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine

C12H24N2 — CID 138669145

IUPAC1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine
SMILESCC(C)C(C)N1CCN(C2CC2)CC1
InChIInChI=1S/C12H24N2/c1-10(2)11(3)13-6-8-14(9-7-13)12-4-5-12/h10-12H,4-9H2,1-3H3
InChIKeyMFLIIFBKBUOOPM-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.81
Rot. Bonds3

About 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine

1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine (PubChem CID 138669145) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine.

Molecular Properties

Compound Name1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine
PubChem CID138669145
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine
SMILESCC(C)C(C)N1CCN(C2CC2)CC1
InChIInChI=1S/C12H24N2/c1-10(2)11(3)13-6-8-14(9-7-13)12-4-5-12/h10-12H,4-9H2,1-3H3
InChIKeyMFLIIFBKBUOOPM-UHFFFAOYSA-N
XLogP1.81
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-4-propan-2-ylpiperazine
CID 59855791
1-cyclopropyl-4-propan-2-ylpiperazine;ethane
CID 169164545
ethane;1-propan-2-yl-4-(4-propan-2-ylcyclohexyl)piperazine
CID 171508742
4-(4-cyclopropylpiperazin-1-yl)pentan-2-amine
CID 64706994
1,4-dicyclohexyl-7-[1-(4,7-dicyclohexyl-1,4,7-triazonan-1-yl)ethyl]-1,4,7-triazonane
CID 23439594
1-cyclopentyl-4-(1-iodoethyl)piperazine
CID 139493034
3-(4-cyclopropylpiperazin-1-yl)butanenitrile
CID 61441190
1-cyclopropyl-4-(3-methylbutan-2-yl)piperidine
CID 155421262
1-[(3R)-1-(3-methylbutan-2-yl)pyrrolidin-3-yl]-4-(2-methylpropyl)piperazine
CID 170062286
N-[2-(4-cyclopropylpiperazin-1-yl)propyl]cyclopropanamine
CID 62411356
ethane;1-(3-methylbutan-2-yl)pyrrolidine
CID 178106115
4-(1-bromoethyl)-1-(3-methylbutan-2-yl)piperidine
CID 130663265

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine?
The IUPAC name of 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine (CID 138669145) is 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine.
What is the SMILES notation for 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine?
The canonical SMILES for 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine is CC(C)C(C)N1CCN(C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine?
The InChIKey is MFLIIFBKBUOOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10(2)11(3)13-6-8-14(9-7-13)12-4-5-12/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine?
1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine has a molecular weight of 196.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-(3-methylbutan-2-yl)piperazine is sourced from PubChem (CID 138669145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).