N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide

C10H20N2O2 — CID 107003381

IUPACN-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NCCOCCN
InChIInChI=1S/C10H20N2O2/c1-10(2)7-8(10)9(13)12-4-6-14-5-3-11/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyYEYWACJDNKCFFR-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.12
Rot. Bonds6

About N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide

N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide (PubChem CID 107003381) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
PubChem CID107003381
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NCCOCCN
InChIInChI=1S/C10H20N2O2/c1-10(2)7-8(10)9(13)12-4-6-14-5-3-11/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyYEYWACJDNKCFFR-UHFFFAOYSA-N
XLogP0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-aminopentyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 107000185
N-(2-fluoroethyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 130635135
S-methyl N-[2-(2-aminoethoxy)ethyl]carbamothioate
CID 139475977
ethyl 4-[(2,2-dimethylcyclopropanecarbonyl)amino]butanoate
CID 103837341
(1S)-N-(2-cyanoethyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 130628725
1-(1-adamantyl)-3-[2-(2-aminoethoxy)ethyl]urea
CID 63766148
N-[2-(2-aminoethoxy)ethyl]oxolane-2-carboxamide
CID 63753369
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamic acid
CID 88921275
N-[2-(2-aminoethoxy)ethyl]-4-butylcyclohexane-1-carboxamide
CID 63754103
(1R)-2,2-dimethyl-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]cyclopropane-1-carboxamide
CID 126423652
tert-butyl N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]carbamate
CID 159460097
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-3-(3-methyldiazirin-3-yl)propanamide
CID 155384555

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide (CID 107003381) is N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide is CC1(C)CC1C(=O)NCCOCCN.
What is the InChIKey of N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is YEYWACJDNKCFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2)7-8(10)9(13)12-4-6-14-5-3-11/h8H,3-7,11H2,1-2H3,(H,12,13).
What are the key properties of N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide?
N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminoethoxy)ethyl]-2,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 107003381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).