N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

C11H22N2O2 — CID 112604290

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NCC1(CN)CC1
InChIInChI=1S/C11H22N2O2/c1-10(2,3)15-6-9(14)13-8-11(7-12)4-5-11/h4-8,12H2,1-3H3,(H,13,14)
InChIKeyPADLJDBTYKOTLF-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.66
Rot. Bonds5

About N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112604290) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112604290
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NCC1(CN)CC1
InChIInChI=1S/C11H22N2O2/c1-10(2,3)15-6-9(14)13-8-11(7-12)4-5-11/h4-8,12H2,1-3H3,(H,13,14)
InChIKeyPADLJDBTYKOTLF-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(aminomethyl)cyclopropyl]methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103212970
N-[3-(4-aminobutylamino)propyl]-2-methoxyacetamide
CID 118721811
N-[4-(3-aminopropylamino)butyl]-2-methoxyacetamide
CID 118721814
2-ethoxy-N-(3-methylbutyl)acetamide
CID 4143880
2-ethoxy-N-[3-(methylamino)propyl]acetamide
CID 43600681
N-(3-acetamidopropyl)-2-propan-2-yloxyacetamide
CID 48139887
N-(3,3-dimethylbutyl)-2-propan-2-yloxyacetamide
CID 48163133
N-(3,3-dimethylbutyl)-2-methoxyacetamide
CID 57945157
N-(3,3-dimethyl-2-oxobutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 58062415
2-methoxy-N-[2-[[(2-methoxyacetyl)amino]methyl]butyl]acetamide
CID 59042443
N-cyclopropyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 60007893
N-(2,2-dimethylpropyl)-2-ethoxyacetamide
CID 61381293

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112604290) is N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)(C)OCC(=O)NCC1(CN)CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is PADLJDBTYKOTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-10(2,3)15-6-9(14)13-8-11(7-12)4-5-11/h4-8,12H2,1-3H3,(H,13,14).
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112604290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).