N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide

C17H25NO3 — CID 100789356

IUPACN-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide
SMILESCOc1cccc(OC)c1CCC(=O)NC1CCCCC1
InChIInChI=1S/C17H25NO3/c1-20-15-9-6-10-16(21-2)14(15)11-12-17(19)18-13-7-4-3-5-8-13/h6,9-10,13H,3-5,7-8,11-12H2,1-2H3,(H,18,19)
InChIKeyKQUJHYBRIYFVLQ-UHFFFAOYSA-N
MW291.39 g/mol
LogP3.09
Rot. Bonds6

About N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide

N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide (PubChem CID 100789356) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide
PubChem CID100789356
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide
SMILESCOc1cccc(OC)c1CCC(=O)NC1CCCCC1
InChIInChI=1S/C17H25NO3/c1-20-15-9-6-10-16(21-2)14(15)11-12-17(19)18-13-7-4-3-5-8-13/h6,9-10,13H,3-5,7-8,11-12H2,1-2H3,(H,18,19)
InChIKeyKQUJHYBRIYFVLQ-UHFFFAOYSA-N
XLogP3.09
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-6-methoxyphenyl)-N-cyclohexylacetamide
CID 69037841
N-cyclohexyl-3-[2-(2-methoxyphenyl)ethylamino]propanamide
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N-cycloheptyl-3-[5-[2-(2-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 25369260
[2-(cyclohexylamino)-2-oxoethyl] 2,3-dimethoxybenzoate
CID 2503827
N-cyclododecyl-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221706
N-cyclopentyl-3-[5-[2-(2-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 42217184
3-(3-amino-4-methoxyphenyl)-N-cyclopentylpropanamide
CID 39362398
N-cyclopropyl-2-(2,3-dimethoxyphenoxy)acetamide
CID 112978329
N-cycloheptyl-4-(3,4-dimethoxyphenyl)-4-oxobutanamide
CID 17457747
N-cyclopentyl-2-(2-methoxyphenyl)sulfanylacetamide
CID 52772357
N-cyclopentyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110407029
N-cyclohexyl-2-ethoxy-3-methoxybenzamide
CID 2988102

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide?
The IUPAC name of N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide (CID 100789356) is N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide is COc1cccc(OC)c1CCC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide?
The InChIKey is KQUJHYBRIYFVLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-20-15-9-6-10-16(21-2)14(15)11-12-17(19)18-13-7-4-3-5-8-13/h6,9-10,13H,3-5,7-8,11-12H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide?
N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide has a molecular weight of 291.39 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(2,6-dimethoxyphenyl)propanamide is sourced from PubChem (CID 100789356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).