4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide

C14H29NO2 — CID 177057859

IUPAC4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide
SMILESCC(C)CCC(=O)NC(C)(C)CCOC(C)C
InChIInChI=1S/C14H29NO2/c1-11(2)7-8-13(16)15-14(5,6)9-10-17-12(3)4/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKeyFOQABQNMSBVKPO-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.13
Rot. Bonds8

About 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide

4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide (PubChem CID 177057859) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide.

Molecular Properties

Compound Name4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide
PubChem CID177057859
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide
SMILESCC(C)CCC(=O)NC(C)(C)CCOC(C)C
InChIInChI=1S/C14H29NO2/c1-11(2)7-8-13(16)15-14(5,6)9-10-17-12(3)4/h11-12H,7-10H2,1-6H3,(H,15,16)
InChIKeyFOQABQNMSBVKPO-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide?
The IUPAC name of 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide (CID 177057859) is 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide.
What is the SMILES notation for 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide?
The canonical SMILES for 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide is CC(C)CCC(=O)NC(C)(C)CCOC(C)C.
What is the InChIKey of 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide?
The InChIKey is FOQABQNMSBVKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-11(2)7-8-13(16)15-14(5,6)9-10-17-12(3)4/h11-12H,7-10H2,1-6H3,(H,15,16).
What are the key properties of 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide?
4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide has a molecular weight of 243.39 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methyl-4-propan-2-yloxybutan-2-yl)pentanamide is sourced from PubChem (CID 177057859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).