5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine

C15H30N2 — CID 64842219

IUPAC5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C(C)(C)C)CN1CC1CC1
InChIInChI=1S/C15H30N2/c1-11(2)13-8-16-14(15(3,4)5)10-17(13)9-12-6-7-12/h11-14,16H,6-10H2,1-5H3
InChIKeyDZJFTPKPGMGEFU-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds3

About 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine

5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine (PubChem CID 64842219) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine
PubChem CID64842219
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C(C)(C)C)CN1CC1CC1
InChIInChI=1S/C15H30N2/c1-11(2)13-8-16-14(15(3,4)5)10-17(13)9-12-6-7-12/h11-14,16H,6-10H2,1-5H3
InChIKeyDZJFTPKPGMGEFU-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine
CID 64939505
5-tert-butyl-2-propan-2-yl-1-(2,2,3,3-tetrafluoropropyl)piperazine
CID 106294168
1-(2-butoxyethyl)-5-tert-butyl-2-propan-2-ylpiperazine
CID 64842412
1-(cyclobutylmethyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937495
1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64934807
5-tert-butyl-1-[2-(3-methoxypropoxy)ethyl]-2-propan-2-ylpiperazine
CID 103184526
4-(5-tert-butyl-2-propan-2-ylpiperazin-1-yl)-N,N-dimethylbutan-1-amine
CID 64946962
5-tert-butyl-1-[2-(oxolan-2-yl)ethyl]-2-propan-2-ylpiperazine
CID 64947681
5-tert-butyl-2-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008736
5-tert-butyl-1-(cyclopentylmethyl)-2-cyclopropylpiperazine
CID 64841267
5-butan-2-yl-1-[(4-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine
CID 64937815
5-methyl-1-[(3-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
CID 107415594

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine?
The IUPAC name of 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine (CID 64842219) is 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine is CC(C)C1CNC(C(C)(C)C)CN1CC1CC1.
What is the InChIKey of 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine?
The InChIKey is DZJFTPKPGMGEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-11(2)13-8-16-14(15(3,4)5)10-17(13)9-12-6-7-12/h11-14,16H,6-10H2,1-5H3.
What are the key properties of 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine?
5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine has a molecular weight of 238.42 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64842219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).