(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one

C9H19N3O — CID 95354967

IUPAC(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one
SMILESCN(C)CCN1CCC[C@@H](N)C1=O
InChIInChI=1S/C9H19N3O/c1-11(2)6-7-12-5-3-4-8(10)9(12)13/h8H,3-7,10H2,1-2H3/t8-/m1/s1
InChIKeyRBDAFFDAVKQVGA-MRVPVSSYSA-N
MW185.27 g/mol
LogP-0.50
Rot. Bonds3

About (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one

(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one (PubChem CID 95354967) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one.

Molecular Properties

Compound Name(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one
PubChem CID95354967
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one
SMILESCN(C)CCN1CCC[C@@H](N)C1=O
InChIInChI=1S/C9H19N3O/c1-11(2)6-7-12-5-3-4-8(10)9(12)13/h8H,3-7,10H2,1-2H3/t8-/m1/s1
InChIKeyRBDAFFDAVKQVGA-MRVPVSSYSA-N
XLogP-0.50
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-(4-hydroxybutyl)piperidin-2-one
CID 106846824
(3R)-3-amino-1-(2-ethylperoxyethyl)piperidin-2-one
CID 88585322
3-amino-1-(2-oxopropyl)piperidin-2-one
CID 71595862
(3S)-3-amino-1-methylpiperidin-2-one
CID 67416126
(3S)-3-amino-1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperidin-2-one
CID 141190377
(3S)-3-amino-1-methylazepan-2-one
CID 14003483
3-amino-1-(2-prop-2-ynylsulfanylethyl)piperidin-2-one
CID 106432535
(3S)-3-amino-1-prop-2-enylazepan-2-one
CID 45088991
methyl 2-[(3S)-3-amino-2-oxopiperidin-1-yl]acetate
CID 10583700
2-[(3S)-3-amino-2-oxoazepan-1-yl]-N-methyl-N-phenylacetamide
CID 155290574
3-amino-1-methylazepan-2-one;hydrochloride
CID 67416250
2-(3-amino-2-oxoazonan-1-yl)acetic acid
CID 23322748

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one?
The IUPAC name of (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one (CID 95354967) is (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one.
What is the SMILES notation for (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one?
The canonical SMILES for (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one is CN(C)CCN1CCC[C@@H](N)C1=O.
What is the InChIKey of (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one?
The InChIKey is RBDAFFDAVKQVGA-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-11(2)6-7-12-5-3-4-8(10)9(12)13/h8H,3-7,10H2,1-2H3/t8-/m1/s1.
What are the key properties of (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one?
(3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one has a molecular weight of 185.27 g/mol, XLogP of -0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-1-[2-(dimethylamino)ethyl]piperidin-2-one is sourced from PubChem (CID 95354967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).