4-methyl-3-piperazin-1-ylpentan-1-ol

C10H22N2O — CID 83817608

IUPAC4-methyl-3-piperazin-1-ylpentan-1-ol
SMILESCC(C)C(CCO)N1CCNCC1
InChIInChI=1S/C10H22N2O/c1-9(2)10(3-8-13)12-6-4-11-5-7-12/h9-11,13H,3-8H2,1-2H3
InChIKeyHHKLQDXWZWZPMO-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.30
Rot. Bonds4

About 4-methyl-3-piperazin-1-ylpentan-1-ol

4-methyl-3-piperazin-1-ylpentan-1-ol (PubChem CID 83817608) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 4-methyl-3-piperazin-1-ylpentan-1-ol.

Molecular Properties

Compound Name4-methyl-3-piperazin-1-ylpentan-1-ol
PubChem CID83817608
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name4-methyl-3-piperazin-1-ylpentan-1-ol
SMILESCC(C)C(CCO)N1CCNCC1
InChIInChI=1S/C10H22N2O/c1-9(2)10(3-8-13)12-6-4-11-5-7-12/h9-11,13H,3-8H2,1-2H3
InChIKeyHHKLQDXWZWZPMO-UHFFFAOYSA-N
XLogP0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2-piperazin-1-ylbutan-1-ol
CID 61317705
(4S)-4-piperazin-1-ylpentan-1-ol
CID 94830721
4-methyl-3-(3-methylazetidin-1-yl)pentan-1-ol
CID 106353495
2-[7-(1-carboxy-3-hydroxypropyl)-1,4,7,10-tetrazacyclododec-1-yl]-4-hydroxybutanoic acid;gadolinium
CID 175945589
(3R)-3-piperazin-1-yl-3-(2,4,5-trimethoxyphenyl)propan-1-ol
CID 171189008
3-piperazin-1-ylbutane-1,2-diol
CID 163627415
(2S)-2-methyl-1-piperazin-1-ylpropane-1,3-diol
CID 163688577
3,3-dimethyl-2-piperazin-1-ylbutan-1-ol
CID 61324971
5-[(1R)-3-hydroxy-1-piperazin-1-ylpropyl]benzene-1,3-diol
CID 171189029
(2S)-3-[4-[(3R)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]butane-1,2,4-triol;tetrahydrochloride
CID 175675084
(2R,3S)-3-(1,4,7,10-tetrazacyclododec-1-yl)butane-1,2,4-triol;tetrahydrochloride
CID 169490742
N-(2-hydroxyethyl)-2-piperazin-1-yl-N-propan-2-ylpropanamide
CID 54995362

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-piperazin-1-ylpentan-1-ol?
The IUPAC name of 4-methyl-3-piperazin-1-ylpentan-1-ol (CID 83817608) is 4-methyl-3-piperazin-1-ylpentan-1-ol.
What is the SMILES notation for 4-methyl-3-piperazin-1-ylpentan-1-ol?
The canonical SMILES for 4-methyl-3-piperazin-1-ylpentan-1-ol is CC(C)C(CCO)N1CCNCC1.
What is the InChIKey of 4-methyl-3-piperazin-1-ylpentan-1-ol?
The InChIKey is HHKLQDXWZWZPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2)10(3-8-13)12-6-4-11-5-7-12/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 4-methyl-3-piperazin-1-ylpentan-1-ol?
4-methyl-3-piperazin-1-ylpentan-1-ol has a molecular weight of 186.30 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-piperazin-1-ylpentan-1-ol is sourced from PubChem (CID 83817608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).