2-amino-1-(2-methylpiperidin-1-yl)ethanone

C8H16N2O — CID 24708863

IUPAC2-amino-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)CN
InChIInChI=1S/C8H16N2O/c1-7-4-2-3-5-10(7)8(11)6-9/h7H,2-6,9H2,1H3
InChIKeyPKURTDDRTXPMFY-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.35
Rot. Bonds1

About 2-amino-1-(2-methylpiperidin-1-yl)ethanone

2-amino-1-(2-methylpiperidin-1-yl)ethanone (PubChem CID 24708863) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-amino-1-(2-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(2-methylpiperidin-1-yl)ethanone
PubChem CID24708863
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-amino-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)CN
InChIInChI=1S/C8H16N2O/c1-7-4-2-3-5-10(7)8(11)6-9/h7H,2-6,9H2,1H3
InChIKeyPKURTDDRTXPMFY-UHFFFAOYSA-N
XLogP0.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(2-methylazetidin-1-yl)ethanone
CID 67101715
3-amino-1-(2-methylpiperidin-1-yl)propan-1-one
CID 16796103
1-(2-methylpiperidin-1-yl)-2-sulfanylethanone
CID 60650037
1,5-bis[(2R)-2-methylpiperidin-1-yl]pentane-1,5-dione
CID 40599340
4-amino-3,3-dimethyl-1-[(2S)-2-methylpiperidin-1-yl]butan-1-one
CID 145040283
2-chloro-1-(2-methylazepan-1-yl)ethanone
CID 21490096
1-[(2S)-2-methylazepan-1-yl]-6-[(2R)-2-methylazepan-1-yl]hexane-1,6-dione
CID 97317052
2-(methylamino)-1-(2-methylpiperidin-1-yl)ethanone
CID 24702742
[2-[(2S)-2-methylpyrrolidin-1-yl]-2-oxoethyl] acetate
CID 71416331
2-(1-aminocyclobutyl)-1-(2-methylazepan-1-yl)ethanone
CID 79854226
2-[methyl-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]amino]acetic acid
CID 43442399
2-[4-(aminomethyl)piperidin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone;hydrochloride
CID 119909747

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-amino-1-(2-methylpiperidin-1-yl)ethanone (CID 24708863) is 2-amino-1-(2-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-amino-1-(2-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-amino-1-(2-methylpiperidin-1-yl)ethanone is CC1CCCCN1C(=O)CN.
What is the InChIKey of 2-amino-1-(2-methylpiperidin-1-yl)ethanone?
The InChIKey is PKURTDDRTXPMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7-4-2-3-5-10(7)8(11)6-9/h7H,2-6,9H2,1H3.
What are the key properties of 2-amino-1-(2-methylpiperidin-1-yl)ethanone?
2-amino-1-(2-methylpiperidin-1-yl)ethanone has a molecular weight of 156.23 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 24708863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).