2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one

C10H20N2O — CID 62123034

IUPAC2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one
SMILESCC(N)C(=O)N1CCCC(C)C1C
InChIInChI=1S/C10H20N2O/c1-7-5-4-6-12(9(7)3)10(13)8(2)11/h7-9H,4-6,11H2,1-3H3
InChIKeyZZVIGJICMPPEGF-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.98
Rot. Bonds1

About 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one

2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one (PubChem CID 62123034) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one
PubChem CID62123034
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one
SMILESCC(N)C(=O)N1CCCC(C)C1C
InChIInChI=1S/C10H20N2O/c1-7-5-4-6-12(9(7)3)10(13)8(2)11/h7-9H,4-6,11H2,1-3H3
InChIKeyZZVIGJICMPPEGF-UHFFFAOYSA-N
XLogP0.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-1-(2,3-dimethylpiperidin-1-yl)-4-methylpentan-1-one
CID 104903392
3-amino-1-(2,3-dimethylpiperidin-1-yl)-2-methylpropan-1-one
CID 55211075
1-(2,3-dimethylpiperidin-1-yl)-2-(methylamino)propan-1-one
CID 62637898
1-(2,3-dimethylpiperidin-1-yl)-2-methoxypropan-1-one
CID 115647053
(2S)-2-amino-1-(2,3-dimethylpiperidin-1-yl)hexan-1-one
CID 103831675
(2R)-2-amino-1-(2,3-dimethylpiperidin-1-yl)-4-methylsulfanylbutan-1-one
CID 104908334
(2S)-1-[(2R)-2-acetylpyrrolidin-1-yl]-2-aminopropan-1-one
CID 59945910
(2R)-1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
CID 23423034
2-bromo-1-(2,3-dimethylpiperidin-1-yl)butan-1-one
CID 62856002
2-amino-1-(2-cyclopropylpyrrolidin-1-yl)propan-1-one;hydrochloride
CID 130978633
(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 12718469
2,3-dimethylpiperidine-1-carbonyl chloride
CID 79886901

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one?
The IUPAC name of 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one (CID 62123034) is 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one is CC(N)C(=O)N1CCCC(C)C1C.
What is the InChIKey of 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one?
The InChIKey is ZZVIGJICMPPEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7-5-4-6-12(9(7)3)10(13)8(2)11/h7-9H,4-6,11H2,1-3H3.
What are the key properties of 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one?
2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one has a molecular weight of 184.28 g/mol, XLogP of 0.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2,3-dimethylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 62123034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).