2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide

C15H18N2O3 — CID 43576582

IUPAC2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
SMILESCC(Oc1ccccc1C#N)C(=O)N(CCO)C1CC1
InChIInChI=1S/C15H18N2O3/c1-11(15(19)17(8-9-18)13-6-7-13)20-14-5-3-2-4-12(14)10-16/h2-5,11,13,18H,6-9H2,1H3
InChIKeyVDJYRGNVPBLHRX-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.31
Rot. Bonds6

About 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide

2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide (PubChem CID 43576582) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
PubChem CID43576582
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
SMILESCC(Oc1ccccc1C#N)C(=O)N(CCO)C1CC1
InChIInChI=1S/C15H18N2O3/c1-11(15(19)17(8-9-18)13-6-7-13)20-14-5-3-2-4-12(14)10-16/h2-5,11,13,18H,6-9H2,1H3
InChIKeyVDJYRGNVPBLHRX-UHFFFAOYSA-N
XLogP1.31
TPSA73.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(2R)-2-(2-cyanophenoxy)propanoyl]-(oxan-4-yl)amino]propanoic acid
CID 125151991
(2R)-2-(2-cyanophenoxy)-N-cyclohexyl-N-prop-2-ynylpropanamide
CID 52509625
2-[2-(2-cyanophenoxy)propanoyl-(oxan-4-yl)amino]acetic acid
CID 119211409
2-(2-cyanophenoxy)-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)propanamide
CID 107483315
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxypropanamide
CID 102684586
2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
CID 43576645
2-(2-cyanophenoxy)-N-(4-hydroxybutyl)propanamide
CID 106843130
2-(2-chlorophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)propanamide
CID 102866620
methyl 2-[2-(2-cyanophenoxy)propanoyl-methylamino]acetate
CID 43423964
methyl 2-[2-(2-cyanophenoxy)propanoyl-propan-2-ylamino]acetate
CID 78884771
2-[2-(2-cyanophenoxy)propanoyl-(2-phenylethyl)amino]acetic acid
CID 120540489
methyl 2-(2-cyanophenoxy)propanoate
CID 21465360

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide (CID 43576582) is 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide is CC(Oc1ccccc1C#N)C(=O)N(CCO)C1CC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The InChIKey is VDJYRGNVPBLHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-11(15(19)17(8-9-18)13-6-7-13)20-14-5-3-2-4-12(14)10-16/h2-5,11,13,18H,6-9H2,1H3.
What are the key properties of 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide has a molecular weight of 274.32 g/mol, XLogP of 1.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 43576582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).