N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide

C15H29NO — CID 59340355

IUPACN-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide
SMILESCC(C)CCN(C(=O)C(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-12(2)10-11-16(15(17)13(3)4)14-8-6-5-7-9-14/h12-14H,5-11H2,1-4H3
InChIKeyKGPNDCAHRUHUCD-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.85
Rot. Bonds5

About N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide

N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide (PubChem CID 59340355) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide
PubChem CID59340355
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide
SMILESCC(C)CCN(C(=O)C(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO/c1-12(2)10-11-16(15(17)13(3)4)14-8-6-5-7-9-14/h12-14H,5-11H2,1-4H3
InChIKeyKGPNDCAHRUHUCD-UHFFFAOYSA-N
XLogP3.85
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide?
The IUPAC name of N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide (CID 59340355) is N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide.
What is the SMILES notation for N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide?
The canonical SMILES for N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide is CC(C)CCN(C(=O)C(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide?
The InChIKey is KGPNDCAHRUHUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(2)10-11-16(15(17)13(3)4)14-8-6-5-7-9-14/h12-14H,5-11H2,1-4H3.
What are the key properties of N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide?
N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide has a molecular weight of 239.40 g/mol, XLogP of 3.85, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methyl-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 59340355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).