3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide

C11H24N2O2 — CID 106112904

IUPAC3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide
SMILESCCC(CC)C(C)NC(=O)C(CN)OC
InChIInChI=1S/C11H24N2O2/c1-5-9(6-2)8(3)13-11(14)10(7-12)15-4/h8-10H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyKJEXINXPZYOOFR-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.90
Rot. Bonds7

About 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide

3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide (PubChem CID 106112904) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide.

Molecular Properties

Compound Name3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide
PubChem CID106112904
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide
SMILESCCC(CC)C(C)NC(=O)C(CN)OC
InChIInChI=1S/C11H24N2O2/c1-5-9(6-2)8(3)13-11(14)10(7-12)15-4/h8-10H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyKJEXINXPZYOOFR-UHFFFAOYSA-N
XLogP0.90
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(3-amino-2-methoxypropanoyl)amino]butanoic acid
CID 106113366
4-amino-N-(3-ethylpentan-2-yl)-3-methoxybutanamide
CID 103155921
3-amino-N-(4-hydroxy-3-methylsulfanylbutan-2-yl)-2-methoxypropanamide
CID 106161500
3-amino-2-methoxy-N-(2-methylbutyl)propanamide
CID 106112770
(2S)-2-amino-N-(3-ethylpentan-2-yl)butanamide
CID 79023204
3-amino-2-methoxy-N-(6-methylheptan-2-yl)propanamide
CID 106112569
3-amino-N-(5-hydroxypentan-2-yl)-2-methoxypropanamide
CID 106113185
(2R)-2-[(3-amino-2-methoxypropanoyl)amino]-4-methylpentanoic acid
CID 106112659
3-amino-2-methoxy-N-(1-methoxypentan-2-yl)propanamide
CID 106112962
2-[(3-amino-2-methoxypropanoyl)amino]hexanoic acid
CID 106112321
(2S)-2-[(3-amino-2-methoxypropanoyl)amino]hexanoic acid
CID 106114110
3-amino-2-methoxy-N-(1-phenylethyl)propanamide
CID 106110983

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide?
The IUPAC name of 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide (CID 106112904) is 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide.
What is the SMILES notation for 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide?
The canonical SMILES for 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide is CCC(CC)C(C)NC(=O)C(CN)OC.
What is the InChIKey of 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide?
The InChIKey is KJEXINXPZYOOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-9(6-2)8(3)13-11(14)10(7-12)15-4/h8-10H,5-7,12H2,1-4H3,(H,13,14).
What are the key properties of 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide?
3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide has a molecular weight of 216.32 g/mol, XLogP of 0.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide is sourced from PubChem (CID 106112904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).