N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide

C11H24N2O2 — CID 63754024

IUPACN-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide
SMILESCCC(C)(C)C(=O)N(C)CC(N)COC
InChIInChI=1S/C11H24N2O2/c1-6-11(2,3)10(14)13(4)7-9(12)8-15-5/h9H,6-8,12H2,1-5H3
InChIKeyYHZUIPYJIPTDEA-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.85
Rot. Bonds6

About N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide

N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide (PubChem CID 63754024) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide.

Molecular Properties

Compound NameN-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide
PubChem CID63754024
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide
SMILESCCC(C)(C)C(=O)N(C)CC(N)COC
InChIInChI=1S/C11H24N2O2/c1-6-11(2,3)10(14)13(4)7-9(12)8-15-5/h9H,6-8,12H2,1-5H3
InChIKeyYHZUIPYJIPTDEA-UHFFFAOYSA-N
XLogP0.85
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(2-amino-3-methoxypropyl)-N-methylcarbamate
CID 63753489
N-(methoxymethyl)-N,2,2-trimethylbutanamide
CID 58226288
N-(2-amino-3-methoxypropyl)-N,2-dimethylpropanamide
CID 63754189
N-(2-amino-3-methoxypropyl)-N-methylheptanamide
CID 114754106
2-amino-N-(2-hydroxy-3-methoxypropyl)-N,2-dimethylbutanamide
CID 79810651
N-(2-amino-3-methoxypropyl)-N-methylcyclopropanecarboxamide
CID 63753647
2-cyano-N-(2-hydroxy-3-methoxypropyl)-N,2-dimethylbutanamide
CID 114291307
N-(2-amino-3-methoxypropyl)-N-methylbenzamide
CID 63753648
N-(3-amino-4-methylpentyl)-N,2,2-trimethylbutanamide
CID 81484329
N-[(dimethylamino)methyl]-N,2,2-trimethylbutanamide
CID 20588097
2-[(2-amino-3-methoxypropyl)-methylamino]-N-tert-butylpropanamide
CID 63761507
N-(2-amino-3-methoxypropyl)-N,1-dimethylcyclohexane-1-carboxamide
CID 106829127

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide?
The IUPAC name of N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide (CID 63754024) is N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide.
What is the SMILES notation for N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide?
The canonical SMILES for N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide is CCC(C)(C)C(=O)N(C)CC(N)COC.
What is the InChIKey of N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide?
The InChIKey is YHZUIPYJIPTDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-6-11(2,3)10(14)13(4)7-9(12)8-15-5/h9H,6-8,12H2,1-5H3.
What are the key properties of N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide?
N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide has a molecular weight of 216.32 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-methoxypropyl)-N,2,2-trimethylbutanamide is sourced from PubChem (CID 63754024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).