1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol

C11H25N3O — CID 64820693

IUPAC1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol
SMILESCCCN1CCN(CCC(O)CN)CC1
InChIInChI=1S/C11H25N3O/c1-2-4-13-6-8-14(9-7-13)5-3-11(15)10-12/h11,15H,2-10,12H2,1H3
InChIKeyCYKKXWWAJUEDTB-UHFFFAOYSA-N
MW215.34 g/mol
LogP-0.28
Rot. Bonds6

About 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol

1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol (PubChem CID 64820693) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol.

Molecular Properties

Compound Name1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol
PubChem CID64820693
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol
SMILESCCCN1CCN(CCC(O)CN)CC1
InChIInChI=1S/C11H25N3O/c1-2-4-13-6-8-14(9-7-13)5-3-11(15)10-12/h11,15H,2-10,12H2,1H3
InChIKeyCYKKXWWAJUEDTB-UHFFFAOYSA-N
XLogP-0.28
TPSA52.73 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 ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-4-(4-ethylpiperidin-1-yl)butan-2-ol
CID 64818908
1-amino-4-(4-propylazepan-1-yl)butan-2-ol
CID 64821373
1-amino-4-[4-(dimethylamino)piperidin-1-yl]butan-2-ol
CID 64821111
1-(4-propylpiperazin-1-yl)pentan-2-ol
CID 62043435
1-amino-4-(4-cyclopentylpiperazin-1-yl)butan-2-ol
CID 64821605
4-(3-hydroxyhexyl)piperazine-1-carbothioamide
CID 145255822
1-amino-4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]butan-2-ol
CID 104961406
2-methyl-3-(4-propylpiperazin-1-yl)butan-1-amine
CID 79414609
2-[2-[4-[4-amino-3-(aminomethyl)butyl]piperazin-1-yl]ethyl]propane-1,3-diamine
CID 68736626
(2S)-1-(4-propylpiperazin-1-yl)pentan-2-amine
CID 93255682
4-(4-propylpiperazin-1-yl)pentan-1-amine
CID 62423620
1-(4-bromophenyl)-3-(4-propylpiperazin-1-yl)propan-1-ol
CID 62618976

Frequently Asked Questions

What is the IUPAC name of 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol?
The IUPAC name of 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol (CID 64820693) is 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol.
What is the SMILES notation for 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol?
The canonical SMILES for 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol is CCCN1CCN(CCC(O)CN)CC1.
What is the InChIKey of 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol?
The InChIKey is CYKKXWWAJUEDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-2-4-13-6-8-14(9-7-13)5-3-11(15)10-12/h11,15H,2-10,12H2,1H3.
What are the key properties of 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol?
1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol has a molecular weight of 215.34 g/mol, XLogP of -0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol is sourced from PubChem (CID 64820693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).