2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide

C18H34N2O2 — CID 14435572

IUPAC2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide
SMILESCC(C)C(=O)NC1(C)CCC(C(C)(C)NC(=O)C(C)C)CC1
InChIInChI=1S/C18H34N2O2/c1-12(2)15(21)19-17(5,6)14-8-10-18(7,11-9-14)20-16(22)13(3)4/h12-14H,8-11H2,1-7H3,(H,19,21)(H,20,22)
InChIKeyOCDHIDXZGXBLEG-UHFFFAOYSA-N
MW310.48 g/mol
LogP3.26
Rot. Bonds5

About 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide

2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide (PubChem CID 14435572) has the molecular formula C18H34N2O2 and a molecular weight of 310.48 g/mol. Its IUPAC name is 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide
PubChem CID14435572
Molecular FormulaC18H34N2O2
Molecular Weight310.48 g/mol
Exact Mass310.26
IUPAC Name2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide
SMILESCC(C)C(=O)NC1(C)CCC(C(C)(C)NC(=O)C(C)C)CC1
InChIInChI=1S/C18H34N2O2/c1-12(2)15(21)19-17(5,6)14-8-10-18(7,11-9-14)20-16(22)13(3)4/h12-14H,8-11H2,1-7H3,(H,19,21)(H,20,22)
InChIKeyOCDHIDXZGXBLEG-UHFFFAOYSA-N
XLogP3.26
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.48
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide?
The IUPAC name of 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide (CID 14435572) is 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide.
What is the SMILES notation for 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide?
The canonical SMILES for 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide is CC(C)C(=O)NC1(C)CCC(C(C)(C)NC(=O)C(C)C)CC1.
What is the InChIKey of 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide?
The InChIKey is OCDHIDXZGXBLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O2/c1-12(2)15(21)19-17(5,6)14-8-10-18(7,11-9-14)20-16(22)13(3)4/h12-14H,8-11H2,1-7H3,(H,19,21)(H,20,22).
What are the key properties of 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide?
2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide has a molecular weight of 310.48 g/mol, XLogP of 3.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-methyl-4-[2-(2-methylpropanoylamino)propan-2-yl]cyclohexyl]propanamide is sourced from PubChem (CID 14435572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).