(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one

C12H24N2O2 — CID 103796402

IUPAC(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one
SMILESCCC[C@@H](N)C(=O)N1CCC(COC)CC1
InChIInChI=1S/C12H24N2O2/c1-3-4-11(13)12(15)14-7-5-10(6-8-14)9-16-2/h10-11H,3-9,13H2,1-2H3/t11-/m1/s1
InChIKeyNYRVPJOCRGZZIC-LLVKDONJSA-N
MW228.34 g/mol
LogP1.00
Rot. Bonds5

About (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one

(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one (PubChem CID 103796402) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one
PubChem CID103796402
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one
SMILESCCC[C@@H](N)C(=O)N1CCC(COC)CC1
InChIInChI=1S/C12H24N2O2/c1-3-4-11(13)12(15)14-7-5-10(6-8-14)9-16-2/h10-11H,3-9,13H2,1-2H3/t11-/m1/s1
InChIKeyNYRVPJOCRGZZIC-LLVKDONJSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-1-[3-(methoxymethyl)piperidin-1-yl]pentan-1-one
CID 103796555
(2S)-2-amino-1-[3-(methoxymethyl)pyrrolidin-1-yl]-4-methylpentan-1-one
CID 64596670
(2S)-2-amino-1-[3-(methoxymethyl)piperidin-1-yl]hexan-1-one
CID 103831721
2-amino-1-[3-(hydroxymethyl)pyrrolidin-1-yl]pentan-1-one
CID 112624987
(2S)-2-amino-1-[4-(dimethylamino)piperidin-1-yl]pentan-1-one
CID 93255628
2-amino-1-[4-(phenoxymethyl)piperidin-1-yl]pentan-1-one;hydrochloride
CID 119304911
2-amino-1-[4-(diethylaminomethyl)piperidin-1-yl]pentan-1-one
CID 54874457
(2S)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]-3,3-dimethylbutan-1-one;hydrochloride
CID 119776125
methyl 4-[(2S)-2-aminopentanoyl]piperazine-1-carboxylate
CID 93469912
(2S)-2-amino-1-(4-propylpiperidin-1-yl)hexan-1-one
CID 113304805
5-amino-1-[4-(methoxymethyl)piperidin-1-yl]-2-methylpentan-1-one
CID 104685126
N-[1-(2-aminopentanoyl)piperidin-4-yl]-N-methylethanesulfonamide
CID 119322034

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one?
The IUPAC name of (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one (CID 103796402) is (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one.
What is the SMILES notation for (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one?
The canonical SMILES for (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one is CCC[C@@H](N)C(=O)N1CCC(COC)CC1.
What is the InChIKey of (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one?
The InChIKey is NYRVPJOCRGZZIC-LLVKDONJSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-4-11(13)12(15)14-7-5-10(6-8-14)9-16-2/h10-11H,3-9,13H2,1-2H3/t11-/m1/s1.
What are the key properties of (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one?
(2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one has a molecular weight of 228.34 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-[4-(methoxymethyl)piperidin-1-yl]pentan-1-one is sourced from PubChem (CID 103796402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).