3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide

C11H22N2O2 — CID 103809924

IUPAC3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide
SMILESCC(C)(CN)C(=O)NCCOCC1CC1
InChIInChI=1S/C11H22N2O2/c1-11(2,8-12)10(14)13-5-6-15-7-9-3-4-9/h9H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyWTNYBPDKRCERKU-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.51
Rot. Bonds7

About 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide

3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide (PubChem CID 103809924) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide
PubChem CID103809924
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide
SMILESCC(C)(CN)C(=O)NCCOCC1CC1
InChIInChI=1S/C11H22N2O2/c1-11(2,8-12)10(14)13-5-6-15-7-9-3-4-9/h9H,3-8,12H2,1-2H3,(H,13,14)
InChIKeyWTNYBPDKRCERKU-UHFFFAOYSA-N
XLogP0.51
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.51
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

2-carbamothioyl-N-[2-(cyclopropylmethoxy)ethyl]-2-ethylbutanamide
CID 114098052
2-[2-[(3-amino-2,2-dimethylpropanoyl)amino]ethoxy]acetic acid
CID 115426845
3-amino-N-[3-(cyclopropylmethoxy)propyl]-2,2-dimethyl-3-sulfanylidenepropanamide
CID 114098055
2-(aminomethyl)-N-[2-(cyclopropylmethoxy)ethyl]cyclohexane-1-carboxamide
CID 114097955
1-[2-(cyclopropylmethoxy)ethyl]-3-(2-hydroxy-3,3-dimethylbutyl)urea
CID 111338531
cyclopropylmethyl 3-amino-2,2-dimethylpropanoate
CID 115428189
4-amino-N-[2-(cyclopropylmethoxy)ethyl]cyclohexane-1-carboxamide
CID 103795970
2-amino-N-[2-(cyclopropylmethoxy)ethyl]butanediamide
CID 103827564
(2S,3S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-3-methylpentanamide
CID 103833000
2-(4-aminophenyl)-N-[3-(cyclopropylmethoxy)propyl]-2-methylpropanamide
CID 80555501
methyl 3-[(3-amino-2,2-dimethylpropanoyl)amino]propanoate
CID 81489476
1-(aminomethyl)-N-[2-(cyclopropylmethoxy)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119755575

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide?
The IUPAC name of 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide (CID 103809924) is 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide?
The canonical SMILES for 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide is CC(C)(CN)C(=O)NCCOCC1CC1.
What is the InChIKey of 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide?
The InChIKey is WTNYBPDKRCERKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,8-12)10(14)13-5-6-15-7-9-3-4-9/h9H,3-8,12H2,1-2H3,(H,13,14).
What are the key properties of 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide?
3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.51, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(cyclopropylmethoxy)ethyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 103809924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).