3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide

C15H28N2O3 — CID 171594077

IUPAC3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
SMILESCNC(=O)C(NC(=O)C(C)C)C(C)OCC1CCCC1
InChIInChI=1S/C15H28N2O3/c1-10(2)14(18)17-13(15(19)16-4)11(3)20-9-12-7-5-6-8-12/h10-13H,5-9H2,1-4H3,(H,16,19)(H,17,18)
InChIKeyXHJZVINNZUMOEW-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.47
Rot. Bonds7

About 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide

3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide (PubChem CID 171594077) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide.

Molecular Properties

Compound Name3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
PubChem CID171594077
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
SMILESCNC(=O)C(NC(=O)C(C)C)C(C)OCC1CCCC1
InChIInChI=1S/C15H28N2O3/c1-10(2)14(18)17-13(15(19)16-4)11(3)20-9-12-7-5-6-8-12/h10-13H,5-9H2,1-4H3,(H,16,19)(H,17,18)
InChIKeyXHJZVINNZUMOEW-UHFFFAOYSA-N
XLogP1.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cycloheptylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide
CID 171593836
2-acetamido-3-(cyclopentylmethoxy)-N-methylbutanamide
CID 164605032
2-acetamido-3-[(4,4-dimethylcyclohexyl)methoxy]-N-methylbutanamide
CID 174329363
2-acetamido-N-methyl-3-(oxan-4-ylmethoxy)butanamide;ethane
CID 164604737
N-methyl-2-(2-methylpropanoylamino)-3-(2-methylpropoxy)butanamide
CID 171593775
2-acetamido-3-(2-cyclohexylethoxy)-N-methylbutanamide
CID 164604698
ethyl 1-[3-(cyclohexylmethoxy)-2-(2-methylpropanoylamino)butanoyl]piperidine-3-carboxylate
CID 171594312
3-[acetyl(cyclohexylmethyl)amino]-N-methyl-2-(2-methylpropanoylamino)butanamide
CID 171594058
2-(cyclopentylmethoxy)-N,3,3-trimethylbutanamide
CID 70921332
N-[3-[(4,4-difluorocyclohexyl)methoxy]-1-oxo-1-[3-(trifluoromethoxymethyl)piperidin-1-yl]butan-2-yl]-2-methylpropanamide
CID 171593725
2-(cyclopentylmethoxy)propanehydrazide
CID 66321450
2-(cyclopentylmethoxy)-3,3-dimethyl-N-propan-2-ylbutanamide
CID 21366296

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide?
The IUPAC name of 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide (CID 171594077) is 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide.
What is the SMILES notation for 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide?
The canonical SMILES for 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide is CNC(=O)C(NC(=O)C(C)C)C(C)OCC1CCCC1.
What is the InChIKey of 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide?
The InChIKey is XHJZVINNZUMOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-10(2)14(18)17-13(15(19)16-4)11(3)20-9-12-7-5-6-8-12/h10-13H,5-9H2,1-4H3,(H,16,19)(H,17,18).
What are the key properties of 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide?
3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide has a molecular weight of 284.40 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylmethoxy)-N-methyl-2-(2-methylpropanoylamino)butanamide is sourced from PubChem (CID 171594077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).