1-benzhydryl-4-ethylpiperazine;ethane

C21H30N2 — CID 156743025

IUPAC1-benzhydryl-4-ethylpiperazine;ethane
SMILESCC.CCN1CCN(C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C19H24N2.C2H6/c1-2-20-13-15-21(16-14-20)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-2/h3-12,19H,2,13-16H2,1H3;1-2H3
InChIKeyHTEIOUUHZLKTDS-UHFFFAOYSA-N
MW310.49 g/mol
LogP4.44
Rot. Bonds4

About 1-benzhydryl-4-ethylpiperazine;ethane

1-benzhydryl-4-ethylpiperazine;ethane (PubChem CID 156743025) has the molecular formula C21H30N2 and a molecular weight of 310.49 g/mol. Its IUPAC name is 1-benzhydryl-4-ethylpiperazine;ethane.

Molecular Properties

Compound Name1-benzhydryl-4-ethylpiperazine;ethane
PubChem CID156743025
Molecular FormulaC21H30N2
Molecular Weight310.49 g/mol
Exact Mass310.24
IUPAC Name1-benzhydryl-4-ethylpiperazine;ethane
SMILESCC.CCN1CCN(C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C19H24N2.C2H6/c1-2-20-13-15-21(16-14-20)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-2/h3-12,19H,2,13-16H2,1H3;1-2H3
InChIKeyHTEIOUUHZLKTDS-UHFFFAOYSA-N
XLogP4.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.49
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-benzhydryl-4-ethylpiperazine;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-benzhydryl-4-butylpiperazine
CID 13416419
1-(4-benzhydrylpiperazin-1-yl)butan-2-ol
CID 20795195
1-[(R)-(4-chlorophenyl)-phenylmethyl]-4-propylpiperazine;1-[(4-chlorophenyl)-phenylmethyl]-4-propylpiperazine;ethane
CID 144798702
1-benzhydryl-4-octylpiperazine
CID 12006583
1-benzhydryl-4-(2-piperidin-1-ylethyl)piperazine
CID 71411855
1-benzhydryl-4-methylpiperazine
CID 6726
1-benzhydryl-4-but-2-ynylpiperazine
CID 20795218
4-(4-benzhydrylpiperazin-1-yl)butan-2-amine
CID 71433044
2-(4-ethylpiperazin-1-yl)-2-phenylacetamide
CID 86915510
1-benzhydryl-4-propan-2-ylpiperazine;2-methylpropane
CID 164924895
1-ethyl-4-[(S)-[1-(2-methylbutan-2-yl)tetrazol-5-yl]-phenylmethyl]piperazine
CID 1444406
1-benzhydryl-4-[[(2R)-oxiran-2-yl]methyl]piperazine
CID 34180767

Frequently Asked Questions

What is the IUPAC name of 1-benzhydryl-4-ethylpiperazine;ethane?
The IUPAC name of 1-benzhydryl-4-ethylpiperazine;ethane (CID 156743025) is 1-benzhydryl-4-ethylpiperazine;ethane.
What is the SMILES notation for 1-benzhydryl-4-ethylpiperazine;ethane?
The canonical SMILES for 1-benzhydryl-4-ethylpiperazine;ethane is CC.CCN1CCN(C(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 1-benzhydryl-4-ethylpiperazine;ethane?
The InChIKey is HTEIOUUHZLKTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2.C2H6/c1-2-20-13-15-21(16-14-20)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-2/h3-12,19H,2,13-16H2,1H3;1-2H3.
What are the key properties of 1-benzhydryl-4-ethylpiperazine;ethane?
1-benzhydryl-4-ethylpiperazine;ethane has a molecular weight of 310.49 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydryl-4-ethylpiperazine;ethane is sourced from PubChem (CID 156743025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).