3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine

C13H27N3 — CID 64924654

IUPAC3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCN1CCNC(C)(C2CC2)C1
InChIInChI=1S/C13H27N3/c1-13(12-5-6-12)11-16(10-7-14-13)9-4-8-15(2)3/h12,14H,4-11H2,1-3H3
InChIKeyFICVSSHMOBLQEK-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.01
Rot. Bonds5

About 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine

3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine (PubChem CID 64924654) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
PubChem CID64924654
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
SMILESCN(C)CCCN1CCNC(C)(C2CC2)C1
InChIInChI=1S/C13H27N3/c1-13(12-5-6-12)11-16(10-7-14-13)9-4-8-15(2)3/h12,14H,4-11H2,1-3H3
InChIKeyFICVSSHMOBLQEK-UHFFFAOYSA-N
XLogP1.01
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-3-methyl-1-octylpiperazine
CID 64833492
3-cyclopropyl-3-methyl-1-pent-4-ynylpiperazine
CID 106221906
1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine
CID 106008956
3-cyclopropyl-1-(3-ethoxypropyl)-3-methylpiperazine
CID 64926000
3-cyclopropyl-3-methyl-1-[3-(2,2,2-trifluoroethoxy)propyl]piperazine
CID 64831509
3-(5-cyclopropyl-2-ethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64935005
3-cyclopropyl-3-methyl-1-pent-4-ynyl-1,4-diazepane
CID 106221926
4-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)-N,N-dimethylbutan-1-amine
CID 64946958
3-cyclopropyl-1-[(3,5-difluorophenyl)methyl]-3-methylpiperazine
CID 105409901
3-cyclopropyl-1-[3-(dimethylamino)propyl]azetidin-3-amine
CID 114526750
3-cyclopropyl-3-methyl-1-(2-phenoxyethyl)piperazine
CID 64833088
3-cyclopropyl-3-methyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
CID 103016188

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine (CID 64924654) is 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine is CN(C)CCCN1CCNC(C)(C2CC2)C1.
What is the InChIKey of 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine?
The InChIKey is FICVSSHMOBLQEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-13(12-5-6-12)11-16(10-7-14-13)9-4-8-15(2)3/h12,14H,4-11H2,1-3H3.
What are the key properties of 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine?
3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 1.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopropyl-3-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 64924654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).