3-acetamido-3-ethyl-4-methylpentanamide

C10H20N2O2 — CID 163651386

IUPAC3-acetamido-3-ethyl-4-methylpentanamide
SMILESCCC(CC(N)=O)(NC(C)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-10(7(2)3,6-9(11)14)12-8(4)13/h7H,5-6H2,1-4H3,(H2,11,14)(H,12,13)
InChIKeyIMOAGPDTYWSNGH-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.80
Rot. Bonds5

About 3-acetamido-3-ethyl-4-methylpentanamide

3-acetamido-3-ethyl-4-methylpentanamide (PubChem CID 163651386) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-acetamido-3-ethyl-4-methylpentanamide.

Molecular Properties

Compound Name3-acetamido-3-ethyl-4-methylpentanamide
PubChem CID163651386
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-acetamido-3-ethyl-4-methylpentanamide
SMILESCCC(CC(N)=O)(NC(C)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-10(7(2)3,6-9(11)14)12-8(4)13/h7H,5-6H2,1-4H3,(H2,11,14)(H,12,13)
InChIKeyIMOAGPDTYWSNGH-UHFFFAOYSA-N
XLogP0.80
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl (2S)-2-acetamido-2-ethyl-3-methylbutanoate
CID 101214772
(2S)-2-acetamido-2-methylbutanoic acid
CID 71355971
3,4-dimethyl-3-propan-2-ylpentanamide
CID 89429040
(2R)-2-ethyl-2-[[(2R)-2-methoxypropanoyl]amino]-3-methylbutanamide
CID 97348922
ethyl (2S)-2-acetamido-2-ethyl-4-methylpentanoate
CID 12042577
3-hydroxy-4-methyl-3-propan-2-ylhexanamide
CID 139781335
3,3-diethyl-5-hydroxypentanamide
CID 21402990
3-[(4-amino-2-methyl-4-oxobutan-2-yl)carbamoylamino]-2-methylbutanoic acid
CID 106097853
2-acetamido-2-ethyl-4-methylhexanoic acid
CID 63702394
3-methyl-3-(methylamino)pentanamide
CID 65236243
acetamide;3,3-bis(sulfanyl)pentanamide;dihydrochloride
CID 163214462
ethane;N-(2-methylbutan-2-yl)acetamide
CID 142252022

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-ethyl-4-methylpentanamide?
The IUPAC name of 3-acetamido-3-ethyl-4-methylpentanamide (CID 163651386) is 3-acetamido-3-ethyl-4-methylpentanamide.
What is the SMILES notation for 3-acetamido-3-ethyl-4-methylpentanamide?
The canonical SMILES for 3-acetamido-3-ethyl-4-methylpentanamide is CCC(CC(N)=O)(NC(C)=O)C(C)C.
What is the InChIKey of 3-acetamido-3-ethyl-4-methylpentanamide?
The InChIKey is IMOAGPDTYWSNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-10(7(2)3,6-9(11)14)12-8(4)13/h7H,5-6H2,1-4H3,(H2,11,14)(H,12,13).
What are the key properties of 3-acetamido-3-ethyl-4-methylpentanamide?
3-acetamido-3-ethyl-4-methylpentanamide has a molecular weight of 200.28 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-ethyl-4-methylpentanamide is sourced from PubChem (CID 163651386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).