2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one

C13H26N2O2 — CID 83625811

IUPAC2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one
SMILESCC(C)COC1CCN(C(=O)C(C)(C)N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)9-17-11-5-7-15(8-6-11)12(16)13(3,4)14/h10-11H,5-9,14H2,1-4H3
InChIKeyOTIBLYPFXNGCFT-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.39
Rot. Bonds4

About 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one

2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one (PubChem CID 83625811) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one
PubChem CID83625811
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one
SMILESCC(C)COC1CCN(C(=O)C(C)(C)N)CC1
InChIInChI=1S/C13H26N2O2/c1-10(2)9-17-11-5-7-15(8-6-11)12(16)13(3,4)14/h10-11H,5-9,14H2,1-4H3
InChIKeyOTIBLYPFXNGCFT-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-methyl-1-(4-propoxyazepan-1-yl)propan-1-one
CID 119321488
2-amino-1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one
CID 110460861
2-[1-(2-amino-2-cyclopropylpropanoyl)piperidin-4-yl]oxyacetic acid
CID 63877468
4-amino-1-[4-(2-methylpropoxy)piperidin-1-yl]pentan-1-one;hydrochloride
CID 120561009
2-(cyclopropylmethylamino)-1-[4-(2-methylpropoxy)piperidin-1-yl]ethanone
CID 119743037
[4-(2-methylpropoxy)piperidin-1-yl]-piperidin-4-ylmethanone
CID 119300129
2-amino-1-[4-(diethylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 61264863
(3-amino-2-bicyclo[2.2.1]heptanyl)-[4-(2-methylpropoxy)piperidin-1-yl]methanone;hydrochloride
CID 119743024
2-amino-2-methyl-1-[4-(3-methylbutyl)piperazin-1-yl]propan-1-one
CID 61265445
3-(4-ethoxypiperidin-1-yl)-2,2-dimethyl-3-oxopropanoic acid
CID 82821841
(1-aminocyclopentyl)-[3-(2-methylpropoxy)pyrrolidin-1-yl]methanone
CID 119345338
1-[4-(2-aminoethoxy)piperidin-1-yl]-2-methoxy-2-methylpropan-1-one
CID 103022562

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one?
The IUPAC name of 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one (CID 83625811) is 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one?
The canonical SMILES for 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one is CC(C)COC1CCN(C(=O)C(C)(C)N)CC1.
What is the InChIKey of 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one?
The InChIKey is OTIBLYPFXNGCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)9-17-11-5-7-15(8-6-11)12(16)13(3,4)14/h10-11H,5-9,14H2,1-4H3.
What are the key properties of 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one?
2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one has a molecular weight of 242.36 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-1-[4-(2-methylpropoxy)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 83625811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).