3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide

C15H29NO2 — CID 129252872

IUPAC3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide
SMILESCOC(C)C(C)C(=O)N(C(C)C)C1CCCC1C
InChIInChI=1S/C15H29NO2/c1-10(2)16(14-9-7-8-11(14)3)15(17)12(4)13(5)18-6/h10-14H,7-9H2,1-6H3
InChIKeyDQIWFEXWHAPQNX-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.08
Rot. Bonds5

About 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide

3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide (PubChem CID 129252872) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide
PubChem CID129252872
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide
SMILESCOC(C)C(C)C(=O)N(C(C)C)C1CCCC1C
InChIInChI=1S/C15H29NO2/c1-10(2)16(14-9-7-8-11(14)3)15(17)12(4)13(5)18-6/h10-14H,7-9H2,1-6H3
InChIKeyDQIWFEXWHAPQNX-UHFFFAOYSA-N
XLogP3.08
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide?
The IUPAC name of 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide (CID 129252872) is 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide?
The canonical SMILES for 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide is COC(C)C(C)C(=O)N(C(C)C)C1CCCC1C.
What is the InChIKey of 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide?
The InChIKey is DQIWFEXWHAPQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-10(2)16(14-9-7-8-11(14)3)15(17)12(4)13(5)18-6/h10-14H,7-9H2,1-6H3.
What are the key properties of 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide?
3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide has a molecular weight of 255.40 g/mol, XLogP of 3.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-(2-methylcyclopentyl)-N-propan-2-ylbutanamide is sourced from PubChem (CID 129252872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).