N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide

C14H16N2O2 — CID 43188643

IUPACN-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
SMILESCC(OCC1CC1)C(=O)Nc1ccccc1C#N
InChIInChI=1S/C14H16N2O2/c1-10(18-9-11-6-7-11)14(17)16-13-5-3-2-4-12(13)8-15/h2-5,10-11H,6-7,9H2,1H3,(H,16,17)
InChIKeyHOZACYVAGIZEHK-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.31
Rot. Bonds5

About N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide

N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide (PubChem CID 43188643) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
PubChem CID43188643
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
SMILESCC(OCC1CC1)C(=O)Nc1ccccc1C#N
InChIInChI=1S/C14H16N2O2/c1-10(18-9-11-6-7-11)14(17)16-13-5-3-2-4-12(13)8-15/h2-5,10-11H,6-7,9H2,1H3,(H,16,17)
InChIKeyHOZACYVAGIZEHK-UHFFFAOYSA-N
XLogP2.31
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 48530161
N-(2-cyanophenyl)-2-cyclobutyloxypropanamide
CID 55041309
2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 86846916
N-(2-cyanophenyl)-2-(2-propoxyethoxy)propanamide
CID 63686205
N-(2-cyanophenyl)-2-[2-(2-methylpropoxy)ethoxy]propanamide
CID 106447596
(2S)-2-amino-N-(2-cyanophenyl)-3-cyclopropylpropanamide
CID 112735200
[(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl] propanoate
CID 7851291
N-(2-cyanophenyl)-2-[cyclopropylmethyl(propyl)amino]propanamide
CID 60689300
N-(2-cyanophenyl)-2-[cyclopropyl(cyclopropylmethyl)amino]propanamide
CID 64522146
(2R)-N-(2-cyanophenyl)-2-(2-ethoxyphenoxy)propanamide
CID 7613071
N-(2-cyanophenyl)-2-[cyclobutylmethyl(methyl)amino]propanamide
CID 62860786
N-(2-cyanophenyl)-2-ethylsulfinylpropanamide
CID 64691502

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide?
The IUPAC name of N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide (CID 43188643) is N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide is CC(OCC1CC1)C(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide?
The InChIKey is HOZACYVAGIZEHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10(18-9-11-6-7-11)14(17)16-13-5-3-2-4-12(13)8-15/h2-5,10-11H,6-7,9H2,1H3,(H,16,17).
What are the key properties of N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide?
N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide has a molecular weight of 244.29 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide is sourced from PubChem (CID 43188643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).