4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol

C16H26N2O — CID 20795319

IUPAC4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol
SMILESCCN1CCN(CCCC(O)c2ccccc2)CC1
InChIInChI=1S/C16H26N2O/c1-2-17-11-13-18(14-12-17)10-6-9-16(19)15-7-4-3-5-8-15/h3-5,7-8,16,19H,2,6,9-14H2,1H3
InChIKeyULNNKNPPKHBALB-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.14
Rot. Bonds6

About 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol

4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol (PubChem CID 20795319) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol.

Molecular Properties

Compound Name4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol
PubChem CID20795319
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol
SMILESCCN1CCN(CCCC(O)c2ccccc2)CC1
InChIInChI=1S/C16H26N2O/c1-2-17-11-13-18(14-12-17)10-6-9-16(19)15-7-4-3-5-8-15/h3-5,7-8,16,19H,2,6,9-14H2,1H3
InChIKeyULNNKNPPKHBALB-UHFFFAOYSA-N
XLogP2.14
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-benzhydrylpiperidin-1-yl)-1-phenylbutan-1-ol
CID 19937449
(1R)-4-(4-benzhydrylpiperazin-1-yl)-1-(4-tert-butylphenyl)butan-1-ol
CID 76965746
2-[4-(3-aminopropyl)piperazin-1-yl]-1-phenylethanol
CID 112513599
3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]-1-phenylpropan-1-ol;ethane
CID 91244751
(1S)-1-phenylpentan-1-ol
CID 6992754
(1S)-1-phenyl-2-[4-(3-phenylpropyl)piperazin-1-yl]ethanol
CID 95308586
3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol
CID 62612441
1-ethyl-4-(3-phenoxypropyl)piperazine
CID 51072960
1-ethyl-4-(4-phenylsulfanylbutyl)piperazine;oxalic acid
CID 2961167
(1R)-1-phenyloctan-1-ol
CID 12794259
N-[1-(4-hydroxy-4-phenylbutyl)piperidin-4-yl]benzenesulfonamide
CID 21426522
1-benzhydryl-4-ethylpiperazine;ethane
CID 156743025

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol?
The IUPAC name of 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol (CID 20795319) is 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol.
What is the SMILES notation for 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol?
The canonical SMILES for 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol is CCN1CCN(CCCC(O)c2ccccc2)CC1.
What is the InChIKey of 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol?
The InChIKey is ULNNKNPPKHBALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-2-17-11-13-18(14-12-17)10-6-9-16(19)15-7-4-3-5-8-15/h3-5,7-8,16,19H,2,6,9-14H2,1H3.
What are the key properties of 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol?
4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol has a molecular weight of 262.40 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperazin-1-yl)-1-phenylbutan-1-ol is sourced from PubChem (CID 20795319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).