N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide

C12H22N2O — CID 103167045

IUPACN-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide
SMILESNCCC1(CNC(=O)CC2CCC2)CC1
InChIInChI=1S/C12H22N2O/c13-7-6-12(4-5-12)9-14-11(15)8-10-2-1-3-10/h10H,1-9,13H2,(H,14,15)
InChIKeyYBFDGWRGWRJCOW-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.42
Rot. Bonds6

About N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide

N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide (PubChem CID 103167045) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide.

Molecular Properties

Compound NameN-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide
PubChem CID103167045
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide
SMILESNCCC1(CNC(=O)CC2CCC2)CC1
InChIInChI=1S/C12H22N2O/c13-7-6-12(4-5-12)9-14-11(15)8-10-2-1-3-10/h10H,1-9,13H2,(H,14,15)
InChIKeyYBFDGWRGWRJCOW-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11480684
N-(cyclopropylmethyl)cyclopentanecarboxamide
CID 45868372
3,5,5-trimethyl-N-(2-methylpropyl)hexanamide
CID 53962467
3,5,5-trimethyl-N-pentylhexanamide
CID 151425945
N-(2-fluoroethyl)spiro[2.3]hexane-2-carboxamide
CID 126996520
N-(2-fluoroethyl)spiro[2.3]hexane-5-carboxamide
CID 137956228
N-[3-(dimethylamino)propyl]-2,4,4-trimethylhexanamide
CID 20250502
N,2,2-triethylcyclobutane-1-carboxamide
CID 20600488
N-(cyclopropylmethyl)-4,4-dimethylpentanamide
CID 20612414
N-(cyclopropylmethyl)cyclobutanecarboxamide
CID 40142577
N,1-diethyl-2-methylcyclopropane-1-carboxamide
CID 54132332
N-methyl-N-[2-(methylamino)ethyl]-1-(2-methylpropyl)cyclopropane-1-carboxamide
CID 57700476

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide?
The IUPAC name of N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide (CID 103167045) is N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide.
What is the SMILES notation for N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide?
The canonical SMILES for N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide is NCCC1(CNC(=O)CC2CCC2)CC1.
What is the InChIKey of N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide?
The InChIKey is YBFDGWRGWRJCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c13-7-6-12(4-5-12)9-14-11(15)8-10-2-1-3-10/h10H,1-9,13H2,(H,14,15).
What are the key properties of N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide?
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide has a molecular weight of 210.32 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-aminoethyl)cyclopropyl]methyl]-2-cyclobutylacetamide is sourced from PubChem (CID 103167045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).