5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine

C18H35N3 — CID 64934370

IUPAC5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
SMILESCCN1CCC(CN2CC(C)(C3CC3)NCC2C(C)C)C1
InChIInChI=1S/C18H35N3/c1-5-20-9-8-15(11-20)12-21-13-18(4,16-6-7-16)19-10-17(21)14(2)3/h14-17,19H,5-13H2,1-4H3
InChIKeyWCGVGAXCBDPSHL-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.43
Rot. Bonds5

About 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine

5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine (PubChem CID 64934370) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
PubChem CID64934370
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
SMILESCCN1CCC(CN2CC(C)(C3CC3)NCC2C(C)C)C1
InChIInChI=1S/C18H35N3/c1-5-20-9-8-15(11-20)12-21-13-18(4,16-6-7-16)19-10-17(21)14(2)3/h14-17,19H,5-13H2,1-4H3
InChIKeyWCGVGAXCBDPSHL-UHFFFAOYSA-N
XLogP2.43
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
CID 64934750
5,5-diethyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
CID 64933993
5-cyclopropyl-5-methyl-2-propan-2-yl-1-(thiolan-3-ylmethyl)piperazine
CID 107298458
5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
CID 64934748
4-[2-(5-cyclopropyl-5-methyl-2-propan-2-ylpiperazin-1-yl)ethyl]thiomorpholine
CID 106326954
5-cyclopropyl-5-methyl-1-pentan-2-yl-2-propan-2-ylpiperazine
CID 64932384
5-cyclopropyl-5-methyl-1-(2-methylpentan-3-yl)-2-propan-2-ylpiperazine
CID 64946234
1-(cyclopropylmethyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64840273
1-[(1-ethylpiperidin-4-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64937578
2-butan-2-yl-5-cyclopropyl-5-methyl-1-propylpiperazine
CID 64876547
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64877110
1-[(2-bromophenyl)methyl]-5-cyclopropyl-5-methyl-2-propan-2-ylpiperazine
CID 64877485

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine?
The IUPAC name of 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine (CID 64934370) is 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine is CCN1CCC(CN2CC(C)(C3CC3)NCC2C(C)C)C1.
What is the InChIKey of 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine?
The InChIKey is WCGVGAXCBDPSHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-5-20-9-8-15(11-20)12-21-13-18(4,16-6-7-16)19-10-17(21)14(2)3/h14-17,19H,5-13H2,1-4H3.
What are the key properties of 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine?
5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine has a molecular weight of 293.50 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64934370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).