2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide

C12H23N3O — CID 96553400

IUPAC2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide
SMILESCN1CCCC[C@@H]1CN(C(=O)CN)C1CC1
InChIInChI=1S/C12H23N3O/c1-14-7-3-2-4-11(14)9-15(10-5-6-10)12(16)8-13/h10-11H,2-9,13H2,1H3/t11-/m1/s1
InChIKeyUKPGQPMLRMFOQH-LLVKDONJSA-N
MW225.34 g/mol
LogP0.42
Rot. Bonds4

About 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide

2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide (PubChem CID 96553400) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide
PubChem CID96553400
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide
SMILESCN1CCCC[C@@H]1CN(C(=O)CN)C1CC1
InChIInChI=1S/C12H23N3O/c1-14-7-3-2-4-11(14)9-15(10-5-6-10)12(16)8-13/h10-11H,2-9,13H2,1H3/t11-/m1/s1
InChIKeyUKPGQPMLRMFOQH-LLVKDONJSA-N
XLogP0.42
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-cyclopropyl-N-[[(2S)-1-methylpyrrolidin-2-yl]methyl]acetamide
CID 66565843
2-chloro-N-cyclopropyl-N-[(1-methylpiperidin-2-yl)methyl]acetamide
CID 66565785
(2S)-2-amino-N-cyclopropyl-N-[(1-methylpyrrolidin-2-yl)methyl]propanamide
CID 66565907
N-methyl-N-[(1-methylpiperidin-2-yl)methyl]hydroxylamine
CID 105431089
2-[cyclopropyl-[[(2R)-1-methylpiperidin-2-yl]methyl]amino]ethanol
CID 96553275
(2S)-2-amino-N-methyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]propanamide
CID 96553417
[(2S)-1-methylpiperidin-2-yl]methylhydrazine
CID 45087985
(2S)-2-amino-N,3-dimethyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]butanamide
CID 96553466
5-amino-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pentanamide
CID 79314072
(2S)-2-amino-N,3-dimethyl-N-[(1-methylpiperidin-2-yl)methyl]butanamide
CID 66565934
2-amino-N-ethyl-3-methyl-N-[[(2S)-1-methylpiperidin-2-yl]methyl]butanamide
CID 121226139
2-[2-(aminomethyl)piperidin-1-yl]-N-cyclopropyl-N-methylacetamide;hydrochloride
CID 119916251

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide?
The IUPAC name of 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide (CID 96553400) is 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide?
The canonical SMILES for 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide is CN1CCCC[C@@H]1CN(C(=O)CN)C1CC1.
What is the InChIKey of 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide?
The InChIKey is UKPGQPMLRMFOQH-LLVKDONJSA-N. The full InChI is InChI=1S/C12H23N3O/c1-14-7-3-2-4-11(14)9-15(10-5-6-10)12(16)8-13/h10-11H,2-9,13H2,1H3/t11-/m1/s1.
What are the key properties of 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide?
2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide has a molecular weight of 225.34 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]acetamide is sourced from PubChem (CID 96553400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).