1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine

C14H27N3 — CID 117025945

IUPAC1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine
SMILESCC1(C)CCN(C2CC2)CC1N1CCNCC1
InChIInChI=1S/C14H27N3/c1-14(2)5-8-17(12-3-4-12)11-13(14)16-9-6-15-7-10-16/h12-13,15H,3-11H2,1-2H3
InChIKeyAATYSHHCKHKNLH-UHFFFAOYSA-N
MW237.39 g/mol
LogP1.15
Rot. Bonds2

About 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine

1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine (PubChem CID 117025945) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine.

Molecular Properties

Compound Name1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine
PubChem CID117025945
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine
SMILESCC1(C)CCN(C2CC2)CC1N1CCNCC1
InChIInChI=1S/C14H27N3/c1-14(2)5-8-17(12-3-4-12)11-13(14)16-9-6-15-7-10-16/h12-13,15H,3-11H2,1-2H3
InChIKeyAATYSHHCKHKNLH-UHFFFAOYSA-N
XLogP1.15
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine
CID 117017868
4-methyl-1-piperidin-4-ylpiperidin-4-ol;hydrochloride
CID 75464899
1-cyclopentylpiperazine;ethane
CID 143559542
1-(4,4-dimethylcyclohexyl)-3-methylpiperazine
CID 64952038
1-(2,2-dimethylcyclohexyl)-6-methyl-1,4-diazepane
CID 79879039
1-(2,2-dimethyl-3-piperazin-1-ylpyrrolidin-1-yl)-2-methylpropan-1-one
CID 115268920
1-(1-tert-butyl-2,2-dimethylpiperidin-3-yl)piperazine
CID 117019904
1-cyclopropyl-3-methylpiperazine
CID 64926788
4-piperazin-1-ylcyclohexan-1-ol
CID 21256600
1-(2,2-dimethylcyclobutyl)-3-methylpiperazine
CID 130554773
3-cyclohexyl-1-(4,4-dimethylcyclohexyl)piperazine
CID 64952444
N-(1-cyclopropylpyrrolidin-3-yl)-4-methylpiperidine-4-carboxamide
CID 55179292

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine?
The IUPAC name of 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine (CID 117025945) is 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine.
What is the SMILES notation for 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine?
The canonical SMILES for 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine is CC1(C)CCN(C2CC2)CC1N1CCNCC1.
What is the InChIKey of 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine?
The InChIKey is AATYSHHCKHKNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-14(2)5-8-17(12-3-4-12)11-13(14)16-9-6-15-7-10-16/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine?
1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine has a molecular weight of 237.39 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine is sourced from PubChem (CID 117025945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).