3-(3-ethylpentan-2-ylamino)-2-methylpropanamide

C11H24N2O — CID 63839004

IUPAC3-(3-ethylpentan-2-ylamino)-2-methylpropanamide
SMILESCCC(CC)C(C)NCC(C)C(N)=O
InChIInChI=1S/C11H24N2O/c1-5-10(6-2)9(4)13-7-8(3)11(12)14/h8-10,13H,5-7H2,1-4H3,(H2,12,14)
InChIKeyIOYNGXOARFZGLY-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.52
Rot. Bonds7

About 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide

3-(3-ethylpentan-2-ylamino)-2-methylpropanamide (PubChem CID 63839004) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide.

Molecular Properties

Compound Name3-(3-ethylpentan-2-ylamino)-2-methylpropanamide
PubChem CID63839004
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-(3-ethylpentan-2-ylamino)-2-methylpropanamide
SMILESCCC(CC)C(C)NCC(C)C(N)=O
InChIInChI=1S/C11H24N2O/c1-5-10(6-2)9(4)13-7-8(3)11(12)14/h8-10,13H,5-7H2,1-4H3,(H2,12,14)
InChIKeyIOYNGXOARFZGLY-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-(3-ethylpentan-2-ylamino)propanamide
CID 103250759
ethyl 2-[(3-amino-2-methyl-3-oxopropyl)amino]propanoate
CID 61498686
3-(ethylamino)-2-methylpropanamide
CID 43311981
3-(heptan-2-ylamino)-2-methylpropanamide
CID 61464618
methane;2-methylbutanamide
CID 158835184
3-ethyl-2-(methylamino)pentanamide
CID 61318910
(2S)-2-amino-N-(3-ethylpentan-2-yl)butanamide
CID 79023204
2-carbamothioyl-N-(3-ethylpentan-2-yl)pentanamide
CID 55259804
2-[[3-(ethylamino)-2-methylpropanoyl]amino]-3-methylbutanamide
CID 106344993
3-(2-hydroxypropylamino)-2-methylpropanamide
CID 43499862
3-(3-ethylpentan-2-ylamino)-2-phenylpropanoic acid
CID 64559425
3-(benzhydrylamino)-2-methylpropanamide
CID 43312171

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide?
The IUPAC name of 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide (CID 63839004) is 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide.
What is the SMILES notation for 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide?
The canonical SMILES for 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide is CCC(CC)C(C)NCC(C)C(N)=O.
What is the InChIKey of 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide?
The InChIKey is IOYNGXOARFZGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-10(6-2)9(4)13-7-8(3)11(12)14/h8-10,13H,5-7H2,1-4H3,(H2,12,14).
What are the key properties of 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide?
3-(3-ethylpentan-2-ylamino)-2-methylpropanamide has a molecular weight of 200.33 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylpentan-2-ylamino)-2-methylpropanamide is sourced from PubChem (CID 63839004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).