[3-(4-propylpiperazin-1-yl)phenyl]methanamine

C14H23N3 — CID 102813325

IUPAC[3-(4-propylpiperazin-1-yl)phenyl]methanamine
SMILESCCCN1CCN(c2cccc(CN)c2)CC1
InChIInChI=1S/C14H23N3/c1-2-6-16-7-9-17(10-8-16)14-5-3-4-13(11-14)12-15/h3-5,11H,2,6-10,12,15H2,1H3
InChIKeyFPEPESDIEHXGEO-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.68
Rot. Bonds4

About [3-(4-propylpiperazin-1-yl)phenyl]methanamine

[3-(4-propylpiperazin-1-yl)phenyl]methanamine (PubChem CID 102813325) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is [3-(4-propylpiperazin-1-yl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(4-propylpiperazin-1-yl)phenyl]methanamine
PubChem CID102813325
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name[3-(4-propylpiperazin-1-yl)phenyl]methanamine
SMILESCCCN1CCN(c2cccc(CN)c2)CC1
InChIInChI=1S/C14H23N3/c1-2-6-16-7-9-17(10-8-16)14-5-3-4-13(11-14)12-15/h3-5,11H,2,6-10,12,15H2,1H3
InChIKeyFPEPESDIEHXGEO-UHFFFAOYSA-N
XLogP1.68
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methylphenyl)-4-propylpiperazine
CID 44570658
[3-[[4-(3-methylphenyl)piperazin-1-yl]methyl]phenyl]methanamine
CID 18070769
[3-(4-propylazepan-1-yl)phenyl]methanamine
CID 102814056
3-(4-propylpiperazin-1-yl)benzonitrile
CID 22397822
(3-piperazin-1-ylphenyl)methanamine
CID 83775094
[3-[4-(2-quinolin-2-ylethyl)piperazin-1-yl]phenyl]methanamine
CID 151351906
[3-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]methanamine
CID 82514499
1-[1-[3-(aminomethyl)phenyl]piperidin-4-yl]ethanol
CID 106835397
ethane;1-(3-ethylphenyl)-4-(3-methylbutyl)piperazine
CID 176934415
[3-(4-propan-2-ylazepan-1-yl)phenyl]methanamine
CID 102814059
3-[4-(2-fluoroethyl)piperazin-1-yl]aniline
CID 80694905
3-[3-(4-propylpiperazin-1-yl)propyl]aniline
CID 115341726

Frequently Asked Questions

What is the IUPAC name of [3-(4-propylpiperazin-1-yl)phenyl]methanamine?
The IUPAC name of [3-(4-propylpiperazin-1-yl)phenyl]methanamine (CID 102813325) is [3-(4-propylpiperazin-1-yl)phenyl]methanamine.
What is the SMILES notation for [3-(4-propylpiperazin-1-yl)phenyl]methanamine?
The canonical SMILES for [3-(4-propylpiperazin-1-yl)phenyl]methanamine is CCCN1CCN(c2cccc(CN)c2)CC1.
What is the InChIKey of [3-(4-propylpiperazin-1-yl)phenyl]methanamine?
The InChIKey is FPEPESDIEHXGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-2-6-16-7-9-17(10-8-16)14-5-3-4-13(11-14)12-15/h3-5,11H,2,6-10,12,15H2,1H3.
What are the key properties of [3-(4-propylpiperazin-1-yl)phenyl]methanamine?
[3-(4-propylpiperazin-1-yl)phenyl]methanamine has a molecular weight of 233.36 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-propylpiperazin-1-yl)phenyl]methanamine is sourced from PubChem (CID 102813325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).