1-methyl-4-(2-propylphenyl)piperazine

C14H22N2 — CID 21034052

IUPAC1-methyl-4-(2-propylphenyl)piperazine
SMILESCCCc1ccccc1N1CCN(C)CC1
InChIInChI=1S/C14H22N2/c1-3-6-13-7-4-5-8-14(13)16-11-9-15(2)10-12-16/h4-5,7-8H,3,6,9-12H2,1-2H3
InChIKeyJXWTVJJJTJFVBZ-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.39
Rot. Bonds3

About 1-methyl-4-(2-propylphenyl)piperazine

1-methyl-4-(2-propylphenyl)piperazine (PubChem CID 21034052) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-methyl-4-(2-propylphenyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(2-propylphenyl)piperazine
PubChem CID21034052
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-methyl-4-(2-propylphenyl)piperazine
SMILESCCCc1ccccc1N1CCN(C)CC1
InChIInChI=1S/C14H22N2/c1-3-6-13-7-4-5-8-14(13)16-11-9-15(2)10-12-16/h4-5,7-8H,3,6,9-12H2,1-2H3
InChIKeyJXWTVJJJTJFVBZ-UHFFFAOYSA-N
XLogP2.39
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(4-methylpiperazin-1-yl)phenyl]propanoic acid
CID 28807045
N-ethyl-1-(2-propylphenyl)piperidin-4-amine
CID 54963841
N-[[2-(4-methyl-1,4-diazepan-1-yl)phenyl]methyl]propan-1-amine
CID 43281328
N-methoxy-1-[2-(4-methylpiperazin-1-yl)phenyl]methanamine
CID 117343517
2-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-phenyl-1,3-dihydroisoindole
CID 90941679
azane;1-(2-butylphenyl)piperidine
CID 70222464
2-methyl-N-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]propan-1-amine
CID 63059430
1-methyl-4-[2-(piperidin-4-ylmethyl)phenyl]piperazine
CID 117436744
1-(2-butylphenyl)piperazine
CID 14479835
1-[2-[(2-ethylimidazol-1-yl)methyl]phenyl]-4-methylpiperazine
CID 58996638
N-[[2-(4-methylpiperazin-1-yl)phenyl]methyl]-4-oxo-4-(4-propylphenyl)butanamide
CID 56523285
1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-(2-propylphenyl)piperazine
CID 46209304

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-propylphenyl)piperazine?
The IUPAC name of 1-methyl-4-(2-propylphenyl)piperazine (CID 21034052) is 1-methyl-4-(2-propylphenyl)piperazine.
What is the SMILES notation for 1-methyl-4-(2-propylphenyl)piperazine?
The canonical SMILES for 1-methyl-4-(2-propylphenyl)piperazine is CCCc1ccccc1N1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(2-propylphenyl)piperazine?
The InChIKey is JXWTVJJJTJFVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-6-13-7-4-5-8-14(13)16-11-9-15(2)10-12-16/h4-5,7-8H,3,6,9-12H2,1-2H3.
What are the key properties of 1-methyl-4-(2-propylphenyl)piperazine?
1-methyl-4-(2-propylphenyl)piperazine has a molecular weight of 218.34 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-propylphenyl)piperazine is sourced from PubChem (CID 21034052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).