2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide

C11H16ClN3O2 — CID 119900750

IUPAC2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCCOc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O2/c1-11(2,13)10(16)14-5-6-17-9-4-3-8(12)7-15-9/h3-4,7H,5-6,13H2,1-2H3,(H,14,16)
InChIKeyWUVGHMVCUVNEJQ-UHFFFAOYSA-N
MW257.72 g/mol
LogP0.97
Rot. Bonds5

About 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide

2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide (PubChem CID 119900750) has the molecular formula C11H16ClN3O2 and a molecular weight of 257.72 g/mol. Its IUPAC name is 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide
PubChem CID119900750
Molecular FormulaC11H16ClN3O2
Molecular Weight257.72 g/mol
Exact Mass257.09
IUPAC Name2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCCOc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O2/c1-11(2,13)10(16)14-5-6-17-9-4-3-8(12)7-15-9/h3-4,7H,5-6,13H2,1-2H3,(H,14,16)
InChIKeyWUVGHMVCUVNEJQ-UHFFFAOYSA-N
XLogP0.97
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylbutanamide
CID 120504371
3-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylbutanamide;dihydrochloride
CID 120504370
(2S)-2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-4-methylpentanamide;dihydrochloride
CID 119900805
4-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-3-methoxybutanamide
CID 120597523
N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2,6-difluorobenzamide
CID 129392827
7-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]heptanamide;dihydrochloride
CID 119900741
N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]thiophene-3-carboxamide
CID 71969648
N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2,2-dimethylpropan-1-amine
CID 115697912
4-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-3-methoxybutanamide;dihydrochloride
CID 120597522
N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropan-1-amine
CID 115876783
tert-butyl N-[2-[(5-methyl-2-pyridinyl)oxy]ethyl]carbamate
CID 145199582
N-[2-(4-chlorophenoxy)ethyl]-2,2-dimethylpropanamide
CID 56922590

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide (CID 119900750) is 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide is CC(C)(N)C(=O)NCCOc1ccc(Cl)cn1.
What is the InChIKey of 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide?
The InChIKey is WUVGHMVCUVNEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O2/c1-11(2,13)10(16)14-5-6-17-9-4-3-8(12)7-15-9/h3-4,7H,5-6,13H2,1-2H3,(H,14,16).
What are the key properties of 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide?
2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide has a molecular weight of 257.72 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[(5-chloro-2-pyridinyl)oxy]ethyl]-2-methylpropanamide is sourced from PubChem (CID 119900750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).