N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide

C15H21NO3 — CID 63294459

IUPACN-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(CCC(=O)NCC(O)C2CC2)c1
InChIInChI=1S/C15H21NO3/c1-19-13-4-2-3-11(9-13)5-8-15(18)16-10-14(17)12-6-7-12/h2-4,9,12,14,17H,5-8,10H2,1H3,(H,16,18)
InChIKeyJGFHZSMFDSCBDC-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.51
Rot. Bonds7

About N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide

N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide (PubChem CID 63294459) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide
PubChem CID63294459
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(CCC(=O)NCC(O)C2CC2)c1
InChIInChI=1S/C15H21NO3/c1-19-13-4-2-3-11(9-13)5-8-15(18)16-10-14(17)12-6-7-12/h2-4,9,12,14,17H,5-8,10H2,1H3,(H,16,18)
InChIKeyJGFHZSMFDSCBDC-UHFFFAOYSA-N
XLogP1.51
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-3-phenylpropyl)-3-(3-methoxyphenyl)propanamide
CID 111102377
1-cyclopropyl-3-(3-methoxyphenyl)propan-1-ol
CID 63354159
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(3-methoxyphenoxy)acetamide
CID 95983036
1-cyclopropyl-2-[(3-methoxyphenyl)methylamino]ethanol
CID 63294606
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-3-(3-methoxyphenyl)propanamide
CID 43035256
N-[(2S)-2-cyclopropyl-2-hydroxyethyl]-2-[3-(trifluoromethoxy)phenyl]acetamide
CID 99850234
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3-(3-methoxyphenyl)propanamide;hydrochloride
CID 119526922
3-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
CID 110737506
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-(3-methoxyphenyl)propanamide
CID 43067247
3-(3-methoxyphenyl)-N-(3-phenylpropyl)propanamide
CID 127121905
2-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 110355667
3-(3-methoxyphenyl)-N-piperidin-4-ylpropanamide
CID 119389634

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide (CID 63294459) is N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide is COc1cccc(CCC(=O)NCC(O)C2CC2)c1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide?
The InChIKey is JGFHZSMFDSCBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-19-13-4-2-3-11(9-13)5-8-15(18)16-10-14(17)12-6-7-12/h2-4,9,12,14,17H,5-8,10H2,1H3,(H,16,18).
What are the key properties of N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide?
N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide has a molecular weight of 263.34 g/mol, XLogP of 1.51, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxyethyl)-3-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 63294459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).