6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide

C19H32N2O2 — CID 178172521

IUPAC6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide
SMILESCOCCC(C)(C)CC(C)(C)C(=O)N(C)CCc1ccccn1
InChIInChI=1S/C19H32N2O2/c1-18(2,11-14-23-6)15-19(3,4)17(22)21(5)13-10-16-9-7-8-12-20-16/h7-9,12H,10-11,13-15H2,1-6H3
InChIKeyKWQBKHZYQPNRPU-UHFFFAOYSA-N
MW320.48 g/mol
LogP3.56
Rot. Bonds9

About 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide

6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide (PubChem CID 178172521) has the molecular formula C19H32N2O2 and a molecular weight of 320.48 g/mol. Its IUPAC name is 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide.

Molecular Properties

Compound Name6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide
PubChem CID178172521
Molecular FormulaC19H32N2O2
Molecular Weight320.48 g/mol
Exact Mass320.25
IUPAC Name6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide
SMILESCOCCC(C)(C)CC(C)(C)C(=O)N(C)CCc1ccccn1
InChIInChI=1S/C19H32N2O2/c1-18(2,11-14-23-6)15-19(3,4)17(22)21(5)13-10-16-9-7-8-12-20-16/h7-9,12H,10-11,13-15H2,1-6H3
InChIKeyKWQBKHZYQPNRPU-UHFFFAOYSA-N
XLogP3.56
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 116816951
2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 60616184
3-amino-3-hydroxyimino-N,2,2-trimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 76919338
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
CID 78796251
N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172839
3-(2-methoxyphenyl)-1-methyl-1-(2-pyridin-2-ylethyl)urea
CID 16612937
phenyl N-methyl-N-(2-pyridin-2-ylethyl)carbamate
CID 60681158
ethane;N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172838
2-methoxy-N-[4-methyl-3-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]phenyl]acetamide
CID 72842851

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide?
The IUPAC name of 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide (CID 178172521) is 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide.
What is the SMILES notation for 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide?
The canonical SMILES for 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide is COCCC(C)(C)CC(C)(C)C(=O)N(C)CCc1ccccn1.
What is the InChIKey of 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide?
The InChIKey is KWQBKHZYQPNRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O2/c1-18(2,11-14-23-6)15-19(3,4)17(22)21(5)13-10-16-9-7-8-12-20-16/h7-9,12H,10-11,13-15H2,1-6H3.
What are the key properties of 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide?
6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide has a molecular weight of 320.48 g/mol, XLogP of 3.56, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,2,2,4,4-pentamethyl-N-(2-pyridin-2-ylethyl)hexanamide is sourced from PubChem (CID 178172521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).