2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one

C13H24N2O2 — CID 103821153

IUPAC2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one
SMILESCOCC1CCCN(C(=O)C(C)(N)C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-13(14,11-5-6-11)12(16)15-7-3-4-10(8-15)9-17-2/h10-11H,3-9,14H2,1-2H3
InChIKeyDQPNLEHYXVMXHM-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.00
Rot. Bonds4

About 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one

2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one (PubChem CID 103821153) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one
PubChem CID103821153
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one
SMILESCOCC1CCCN(C(=O)C(C)(N)C2CC2)C1
InChIInChI=1S/C13H24N2O2/c1-13(14,11-5-6-11)12(16)15-7-3-4-10(8-15)9-17-2/h10-11H,3-9,14H2,1-2H3
InChIKeyDQPNLEHYXVMXHM-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-[3-(methoxymethyl)piperidin-1-yl]-2-methylpropan-1-one;hydrochloride
CID 119322528
2-amino-2-ethyl-1-[3-(methoxymethyl)piperidin-1-yl]butan-1-one
CID 106586761
(2S)-2-amino-1-[3-(methoxymethyl)piperidin-1-yl]-3,3-dimethylbutan-1-one
CID 103810680
2-amino-1-[3-(methoxymethyl)piperidin-1-yl]-2-phenylpropan-1-one
CID 106586749
2-amino-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpropan-1-one;hydrochloride
CID 119322639
3-amino-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethylpropan-1-one
CID 64569299
3-(methoxymethyl)azepane-1-carboxamide
CID 130671584
2-bromo-1-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpropan-1-one
CID 114328777
azepan-1-yl-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106586477
3-amino-2-methoxy-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one
CID 106114088
2-amino-1-[3-(methoxymethyl)piperidin-1-yl]pentan-1-one
CID 103796555
3-(methoxymethyl)-N-methylpiperidine-1-carboxamide
CID 103663303

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one (CID 103821153) is 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one is COCC1CCCN(C(=O)C(C)(N)C2CC2)C1.
What is the InChIKey of 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one?
The InChIKey is DQPNLEHYXVMXHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(14,11-5-6-11)12(16)15-7-3-4-10(8-15)9-17-2/h10-11H,3-9,14H2,1-2H3.
What are the key properties of 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one?
2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one has a molecular weight of 240.35 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-1-[3-(methoxymethyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 103821153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).