1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine

C19H30N2 — CID 64941245

IUPAC1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine
SMILESCCC(CC1CC1)N1CC(C)(c2ccccc2)NCC1C
InChIInChI=1S/C19H30N2/c1-4-18(12-16-10-11-16)21-14-19(3,20-13-15(21)2)17-8-6-5-7-9-17/h5-9,15-16,18,20H,4,10-14H2,1-3H3
InChIKeyQYNDXHIOAYOMNB-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.77
Rot. Bonds5

About 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine

1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine (PubChem CID 64941245) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine.

Molecular Properties

Compound Name1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine
PubChem CID64941245
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine
SMILESCCC(CC1CC1)N1CC(C)(c2ccccc2)NCC1C
InChIInChI=1S/C19H30N2/c1-4-18(12-16-10-11-16)21-14-19(3,20-13-15(21)2)17-8-6-5-7-9-17/h5-9,15-16,18,20H,4,10-14H2,1-3H3
InChIKeyQYNDXHIOAYOMNB-UHFFFAOYSA-N
XLogP3.77
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-hexan-3-yl-2,5-dimethyl-5-phenylpiperazine
CID 64947170
1-(1-cyclopropylbutan-2-yl)-3-methyl-3-phenylpiperazine
CID 64952228
1-(1-cyclopropylpropan-2-yl)-2-ethyl-5-methyl-5-phenylpiperazine
CID 64941635
1-but-3-en-2-yl-2,5-dimethyl-5-phenylpiperazine
CID 113480602
4-(1-cyclopropylbutan-2-yl)-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64940472
1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine
CID 64935365
2,5-dimethyl-5-phenyl-1-(1-thiophen-3-ylethyl)piperazine
CID 64940197
2-cyclopropyl-5-methyl-5-phenyl-1-propylpiperazine
CID 64860974
1-(2-methoxyethyl)-2,5-dimethyl-5-phenylpiperazine
CID 64861931
2-cyclopropyl-1,5-dimethyl-5-phenylpiperazine
CID 64862132
1-ethyl-5-methyl-5-phenyl-2-propylpiperazine
CID 64862477
1-(cyclopentylmethyl)-2-ethyl-5-methyl-5-phenylpiperazine
CID 64861936

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine?
The IUPAC name of 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine (CID 64941245) is 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine.
What is the SMILES notation for 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine?
The canonical SMILES for 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine is CCC(CC1CC1)N1CC(C)(c2ccccc2)NCC1C.
What is the InChIKey of 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine?
The InChIKey is QYNDXHIOAYOMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-4-18(12-16-10-11-16)21-14-19(3,20-13-15(21)2)17-8-6-5-7-9-17/h5-9,15-16,18,20H,4,10-14H2,1-3H3.
What are the key properties of 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine?
1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine has a molecular weight of 286.46 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine is sourced from PubChem (CID 64941245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).