3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol

C14H22N2O — CID 43393739

IUPAC3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol
SMILESCN1CCN(CCCO)C(c2ccccc2)C1
InChIInChI=1S/C14H22N2O/c1-15-9-10-16(8-5-11-17)14(12-15)13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3
InChIKeyXBJHJJJODNWDNQ-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.36
Rot. Bonds4

About 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol

3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol (PubChem CID 43393739) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol
PubChem CID43393739
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol
SMILESCN1CCN(CCCO)C(c2ccccc2)C1
InChIInChI=1S/C14H22N2O/c1-15-9-10-16(8-5-11-17)14(12-15)13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3
InChIKeyXBJHJJJODNWDNQ-UHFFFAOYSA-N
XLogP1.36
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-methyl-2-phenylpiperazin-1-yl)pentan-1-ol
CID 62227844
methyl 4-(4-methyl-2-phenylpiperazin-1-yl)butanoate
CID 43377701
3-(4-methyl-2-phenylpiperazin-1-yl)propanal
CID 63039379
(2R)-1-(4-methyl-2-phenylpiperazin-1-yl)propan-2-ol
CID 113354637
3,3-dimethyl-1-(4-methyl-2-phenylpiperazin-1-yl)butan-2-one
CID 43229060
N-[3-[(2S)-4-methyl-2-phenylpiperazin-1-yl]propyl]-3-phenylpropanamide
CID 37295921
(2R)-N-[3-[(2R)-4-methyl-2-phenylpiperazin-1-yl]propyl]-2-phenylbutanamide
CID 124813932
1-methoxy-3-(4-methyl-2-phenylpiperazin-1-yl)propan-2-one
CID 107507077
N',4-dimethyl-N-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]piperidine-1-carboximidamide
CID 111211763
1-ethyl-3-[3-(4-methyl-2-phenylpiperazin-1-yl)propyl]-2-propylguanidine
CID 111226835
1-[(3,3-dimethyloxiran-2-yl)methyl]-4-methyl-2-phenylpiperazine
CID 167753879
[2-[(4-methyl-2-phenylpiperazin-1-yl)methyl]phenyl]methanamine
CID 18070759

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol?
The IUPAC name of 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol (CID 43393739) is 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol.
What is the SMILES notation for 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol?
The canonical SMILES for 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol is CN1CCN(CCCO)C(c2ccccc2)C1.
What is the InChIKey of 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol?
The InChIKey is XBJHJJJODNWDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-15-9-10-16(8-5-11-17)14(12-15)13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3.
What are the key properties of 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol?
3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-2-phenylpiperazin-1-yl)propan-1-ol is sourced from PubChem (CID 43393739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).