2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol

C11H25N3O — CID 64797363

IUPAC2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol
SMILESCCNC(CO)CCN1CCN(C)CC1
InChIInChI=1S/C11H25N3O/c1-3-12-11(10-15)4-5-14-8-6-13(2)7-9-14/h11-12,15H,3-10H2,1-2H3
InChIKeyANEOUMNGXVZYNK-UHFFFAOYSA-N
MW215.34 g/mol
LogP-0.41
Rot. Bonds6

About 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol

2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol (PubChem CID 64797363) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol
PubChem CID64797363
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol
SMILESCCNC(CO)CCN1CCN(C)CC1
InChIInChI=1S/C11H25N3O/c1-3-12-11(10-15)4-5-14-8-6-13(2)7-9-14/h11-12,15H,3-10H2,1-2H3
InChIKeyANEOUMNGXVZYNK-UHFFFAOYSA-N
XLogP-0.41
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-cyclopropylpiperazin-1-yl)-2-(ethylamino)butan-1-ol
CID 64827038
4-(4,4-dimethylpiperidin-1-yl)-2-(ethylamino)butan-1-ol
CID 64791854
4-(3,4-dimethylpiperazin-1-yl)-2-(ethylamino)butan-1-ol
CID 64791833
4-[4-(dimethylamino)piperidin-1-yl]-2-(ethylamino)butan-1-ol
CID 64796209
4-(4-ethylpiperazin-1-yl)-2-(methylamino)butan-1-ol
CID 64797345
2-(ethylamino)-4-[methyl(2-pyrrolidin-1-ylethyl)amino]butan-1-ol
CID 64791268
4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(ethylamino)butan-1-ol
CID 79924497
4-(azocan-1-yl)-2-(propylamino)butan-1-ol
CID 64798605
4-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-(propylamino)butan-1-ol
CID 64788204
4-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-(ethylamino)butan-1-ol
CID 81469479
2-(ethylamino)-4-(3-morpholin-4-ylpyrrolidin-1-yl)butan-1-ol
CID 64791294
2-(propylamino)-4-(3,3,4-trimethylpiperazin-1-yl)butan-1-ol
CID 64791406

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol (CID 64797363) is 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol is CCNC(CO)CCN1CCN(C)CC1.
What is the InChIKey of 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol?
The InChIKey is ANEOUMNGXVZYNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-3-12-11(10-15)4-5-14-8-6-13(2)7-9-14/h11-12,15H,3-10H2,1-2H3.
What are the key properties of 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol?
2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol has a molecular weight of 215.34 g/mol, XLogP of -0.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(4-methylpiperazin-1-yl)butan-1-ol is sourced from PubChem (CID 64797363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).