2-methoxy-N-(3-methylpentan-2-yl)propanamide

C10H21NO2 — CID 115591162

IUPAC2-methoxy-N-(3-methylpentan-2-yl)propanamide
SMILESCCC(C)C(C)NC(=O)C(C)OC
InChIInChI=1S/C10H21NO2/c1-6-7(2)8(3)11-10(12)9(4)13-5/h7-9H,6H2,1-5H3,(H,11,12)
InChIKeyNAXNFPPQGMHQPC-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.57
Rot. Bonds5

About 2-methoxy-N-(3-methylpentan-2-yl)propanamide

2-methoxy-N-(3-methylpentan-2-yl)propanamide (PubChem CID 115591162) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-methoxy-N-(3-methylpentan-2-yl)propanamide.

Molecular Properties

Compound Name2-methoxy-N-(3-methylpentan-2-yl)propanamide
PubChem CID115591162
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-methoxy-N-(3-methylpentan-2-yl)propanamide
SMILESCCC(C)C(C)NC(=O)C(C)OC
InChIInChI=1S/C10H21NO2/c1-6-7(2)8(3)11-10(12)9(4)13-5/h7-9H,6H2,1-5H3,(H,11,12)
InChIKeyNAXNFPPQGMHQPC-UHFFFAOYSA-N
XLogP1.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-(3-methylbutan-2-yl)propanamide
CID 115587528
N-[(2R)-3-methylpentan-2-yl]propanamide
CID 145216410
1-(3-methylpentan-2-yl)-3-propan-2-ylurea
CID 115591147
N-[(2R)-1-aminopropan-2-yl]-2-methoxypropanamide
CID 104873046
N-(1-ethoxy-3-methylbutan-2-yl)-2-methoxypropanamide
CID 103274835
N,N-diethyl-2-(2-methoxypropanoylamino)propanamide
CID 115588502
N-(3-methylpentan-2-yl)prop-2-ynamide
CID 126988457
2-amino-N-(3-methylpentan-2-yl)-4-methylsulfonylbutanamide
CID 54950405
2-(2-methoxypropanoylamino)propanamide
CID 115588153
(2R)-2-methoxy-N-[(2S,3R)-3-phenylbutan-2-yl]propanamide
CID 96522716
N-hex-1-yn-3-yl-2-methoxypropanamide
CID 103528920
3-amino-N-(3-ethylpentan-2-yl)-2-methoxypropanamide
CID 106112904

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-methylpentan-2-yl)propanamide?
The IUPAC name of 2-methoxy-N-(3-methylpentan-2-yl)propanamide (CID 115591162) is 2-methoxy-N-(3-methylpentan-2-yl)propanamide.
What is the SMILES notation for 2-methoxy-N-(3-methylpentan-2-yl)propanamide?
The canonical SMILES for 2-methoxy-N-(3-methylpentan-2-yl)propanamide is CCC(C)C(C)NC(=O)C(C)OC.
What is the InChIKey of 2-methoxy-N-(3-methylpentan-2-yl)propanamide?
The InChIKey is NAXNFPPQGMHQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-6-7(2)8(3)11-10(12)9(4)13-5/h7-9H,6H2,1-5H3,(H,11,12).
What are the key properties of 2-methoxy-N-(3-methylpentan-2-yl)propanamide?
2-methoxy-N-(3-methylpentan-2-yl)propanamide has a molecular weight of 187.28 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-methylpentan-2-yl)propanamide is sourced from PubChem (CID 115591162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).