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

C17H33N3 — CID 64934750

IUPAC5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C2CC2)CN1CC1CCN(C)C1
InChIInChI=1S/C17H33N3/c1-13(2)16-9-18-17(3,15-5-6-15)12-20(16)11-14-7-8-19(4)10-14/h13-16,18H,5-12H2,1-4H3
InChIKeyLNBDZICTBDEZMC-UHFFFAOYSA-N
MW279.47 g/mol
LogP2.04
Rot. Bonds4

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

5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine (PubChem CID 64934750) has the molecular formula C17H33N3 and a molecular weight of 279.47 g/mol. Its IUPAC name is 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
PubChem CID64934750
Molecular FormulaC17H33N3
Molecular Weight279.47 g/mol
Exact Mass279.27
IUPAC Name5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C2CC2)CN1CC1CCN(C)C1
InChIInChI=1S/C17H33N3/c1-13(2)16-9-18-17(3,15-5-6-15)12-20(16)11-14-7-8-19(4)10-14/h13-16,18H,5-12H2,1-4H3
InChIKeyLNBDZICTBDEZMC-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.47
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopropyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64934370
5-cyclopropyl-5-methyl-2-propan-2-yl-1-(thiolan-3-ylmethyl)piperazine
CID 107298458
4-[2-(5-cyclopropyl-5-methyl-2-propan-2-ylpiperazin-1-yl)ethyl]thiomorpholine
CID 106326954
9-[(1-methylpiperidin-3-yl)methyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64947685
5-cyclopropyl-1-(3-methoxy-3-methylbutyl)-5-methyl-2-propan-2-ylpiperazine
CID 103016594
5-cyclopropyl-5-methyl-1-pentan-2-yl-2-propan-2-ylpiperazine
CID 64932384
1-(cyclopropylmethyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64840273
5,5-diethyl-1-[(1-ethylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine
CID 64933993
2-butan-2-yl-5-cyclopropyl-5-methyl-1-propylpiperazine
CID 64876547
1-[(2-bromophenyl)methyl]-5-cyclopropyl-5-methyl-2-propan-2-ylpiperazine
CID 64877485
5-cyclopropyl-1-[(2-fluorophenyl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64877110
5-cyclopropyl-5-methyl-1-[(3-methylphenyl)methyl]-2-propan-2-ylpiperazine
CID 64876545

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine?
The IUPAC name of 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine (CID 64934750) is 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine?
The canonical SMILES for 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine is CC(C)C1CNC(C)(C2CC2)CN1CC1CCN(C)C1.
What is the InChIKey of 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine?
The InChIKey is LNBDZICTBDEZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3/c1-13(2)16-9-18-17(3,15-5-6-15)12-20(16)11-14-7-8-19(4)10-14/h13-16,18H,5-12H2,1-4H3.
What are the key properties of 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine?
5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine has a molecular weight of 279.47 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-5-methyl-1-[(1-methylpyrrolidin-3-yl)methyl]-2-propan-2-ylpiperazine is sourced from PubChem (CID 64934750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).