N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide

C15H29NO2 — CID 145047882

IUPACN-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide
SMILESCOCCCC(=O)N(CC(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO2/c1-13(2)12-16(14-8-5-4-6-9-14)15(17)10-7-11-18-3/h13-14H,4-12H2,1-3H3
InChIKeyREHSBDCXLOONTB-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.23
Rot. Bonds7

About N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide

N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide (PubChem CID 145047882) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide.

Molecular Properties

Compound NameN-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide
PubChem CID145047882
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC NameN-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide
SMILESCOCCCC(=O)N(CC(C)C)C1CCCCC1
InChIInChI=1S/C15H29NO2/c1-13(2)12-16(14-8-5-4-6-9-14)15(17)10-7-11-18-3/h13-14H,4-12H2,1-3H3
InChIKeyREHSBDCXLOONTB-UHFFFAOYSA-N
XLogP3.23
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)butanamide
CID 78884888
4-methoxy-N-methyl-N-(4-propan-2-ylcyclohexyl)butanamide
CID 58394583
N-cyclobutyl-N-(2-methylpropyl)acetamide
CID 143031247
methyl 2-[cyclopentyl(4-ethoxybutanoyl)amino]acetate
CID 80709869
propan-2-yl N-cyclopentyl-N-(2-methylpropyl)carbamate
CID 116656757
N-cyclohexyl-5-propan-2-yloxy-N-propylpentanamide
CID 153483419
3-cyclopentylsulfonyl-N-cyclopropyl-N-(2-methylpropyl)propanamide
CID 78883966
N-(3-aminopropyl)-N-cycloheptyl-4-methylpentanamide
CID 43319420
N,N'-dicyclohexyl-N,N'-diethyltetradecanediamide
CID 20752264
2-(tert-butylamino)-N-cyclopentyl-N-(2-methylpropyl)acetamide
CID 112727507
N-(2-bromoethyl)-N-cyclohexyl-4-methylpentanamide
CID 80658610
3-[cyclopropyl(4-propan-2-yloxybutanoyl)amino]-2-methylpropanoic acid
CID 120689469

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide?
The IUPAC name of N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide (CID 145047882) is N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide.
What is the SMILES notation for N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide?
The canonical SMILES for N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide is COCCCC(=O)N(CC(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide?
The InChIKey is REHSBDCXLOONTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-13(2)12-16(14-8-5-4-6-9-14)15(17)10-7-11-18-3/h13-14H,4-12H2,1-3H3.
What are the key properties of N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide?
N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide has a molecular weight of 255.40 g/mol, XLogP of 3.23, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide is sourced from PubChem (CID 145047882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).