N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide

C11H22N2O2 — CID 104760412

IUPACN-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide
SMILESCOC(C)(C)CNCCC(=O)NC1CC1
InChIInChI=1S/C11H22N2O2/c1-11(2,15-3)8-12-7-6-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyAJRRNPAGVKZHCO-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.67
Rot. Bonds7

About N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide

N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide (PubChem CID 104760412) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide
PubChem CID104760412
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide
SMILESCOC(C)(C)CNCCC(=O)NC1CC1
InChIInChI=1S/C11H22N2O2/c1-11(2,15-3)8-12-7-6-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyAJRRNPAGVKZHCO-UHFFFAOYSA-N
XLogP0.67
TPSA50.36 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 ≤ 50.67
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

3-[[3-(cyclopropylamino)-3-oxopropyl]amino]-2,2-dimethylpropanoic acid
CID 79623575
3-[[3-(cyclopropylamino)-3-oxopropyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 104644717
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
3-(cyanomethylamino)-N-cyclopropylpropanamide
CID 79394850
N-cyclopropyl-4-[(2-hydroxy-2-methylpropyl)amino]butanamide
CID 79393786
tert-butyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate
CID 24688554
N-cyclopropyl-3-(2-methylpropylamino)propanamide
CID 62626467
N-cyclopropyl-3-[2-(3-methoxypropoxy)ethylamino]propanamide
CID 103179172
N-cyclopropyl-3-(2-methylsulfanylethylamino)propanamide
CID 62352584
tert-butyl N-tert-butyl-N-[2-[[3-(cyclopropylamino)-3-oxopropyl]amino]ethyl]carbamate
CID 107445831
N,N'-dicyclopropylbutanediamide
CID 5225156
N-cyclopropyl-3-(octylamino)propanamide
CID 79393740

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide (CID 104760412) is N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide is COC(C)(C)CNCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide?
The InChIKey is AJRRNPAGVKZHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,15-3)8-12-7-6-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14).
What are the key properties of N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide?
N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(2-methoxy-2-methylpropyl)amino]propanamide is sourced from PubChem (CID 104760412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).