2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol

C11H25N3O — CID 64790408

IUPAC2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol
SMILESCN1CCN(CC(C)(N)CO)CC1(C)C
InChIInChI=1S/C11H25N3O/c1-10(2)7-14(6-5-13(10)4)8-11(3,12)9-15/h15H,5-9,12H2,1-4H3
InChIKeyGNYWJOBXODOBEM-UHFFFAOYSA-N
MW215.34 g/mol
LogP-0.28
Rot. Bonds3

About 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol

2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol (PubChem CID 64790408) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol
PubChem CID64790408
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol
SMILESCN1CCN(CC(C)(N)CO)CC1(C)C
InChIInChI=1S/C11H25N3O/c1-10(2)7-14(6-5-13(10)4)8-11(3,12)9-15/h15H,5-9,12H2,1-4H3
InChIKeyGNYWJOBXODOBEM-UHFFFAOYSA-N
XLogP-0.28
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
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

2-methyl-1-(3,3,4-trimethylpiperazin-1-yl)butan-2-amine
CID 79810631
2-amino-2-cyclopropyl-3-(3,3,4-trimethylpiperazin-1-yl)propanoic acid
CID 63926025
2-cyclopropyl-2-(ethylamino)-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol
CID 64790209
2,2-dimethyl-4-(3,3,4-trimethylpiperazin-1-yl)butanethioamide
CID 65249097
2-amino-2-methyl-3-[4-(2-methylpropyl)piperazin-1-yl]propan-1-ol
CID 64788004
2-amino-3-[4-(cyclopropylmethyl)piperazin-1-yl]-2-methylpropan-1-ol
CID 64828005
1-amino-3-(3,3,4-trimethylpiperazin-1-yl)propan-2-ol
CID 63608754
ethyl 2-amino-2-methyl-5-(3,3,4-trimethylpiperazin-1-yl)pentanoate
CID 63633515
4-methoxy-4-methyl-1-(3,3,4-trimethylpiperazin-1-yl)pentan-3-one
CID 114228996
2,2-dimethyl-5-(3,3,4-trimethylpiperazin-1-yl)pentanoic acid
CID 65254593
methyl 2-(cyclopropylamino)-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propanoate
CID 63635966
2-amino-4-(4,4-dimethylpiperidin-1-yl)-2-methylbutan-1-ol
CID 64791445

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol?
The IUPAC name of 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol (CID 64790408) is 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol is CN1CCN(CC(C)(N)CO)CC1(C)C.
What is the InChIKey of 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol?
The InChIKey is GNYWJOBXODOBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-10(2)7-14(6-5-13(10)4)8-11(3,12)9-15/h15H,5-9,12H2,1-4H3.
What are the key properties of 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol?
2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol has a molecular weight of 215.34 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-3-(3,3,4-trimethylpiperazin-1-yl)propan-1-ol is sourced from PubChem (CID 64790408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).