4-(cyclopropylmethoxy)-N-ethylbenzamide

C13H17NO2 — CID 60572461

IUPAC4-(cyclopropylmethoxy)-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(OCC2CC2)cc1
InChIInChI=1S/C13H17NO2/c1-2-14-13(15)11-5-7-12(8-6-11)16-9-10-3-4-10/h5-8,10H,2-4,9H2,1H3,(H,14,15)
InChIKeyAOSUMXKPIMBOAI-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.23
Rot. Bonds5

About 4-(cyclopropylmethoxy)-N-ethylbenzamide

4-(cyclopropylmethoxy)-N-ethylbenzamide (PubChem CID 60572461) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 4-(cyclopropylmethoxy)-N-ethylbenzamide.

Molecular Properties

Compound Name4-(cyclopropylmethoxy)-N-ethylbenzamide
PubChem CID60572461
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name4-(cyclopropylmethoxy)-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(OCC2CC2)cc1
InChIInChI=1S/C13H17NO2/c1-2-14-13(15)11-5-7-12(8-6-11)16-9-10-3-4-10/h5-8,10H,2-4,9H2,1H3,(H,14,15)
InChIKeyAOSUMXKPIMBOAI-UHFFFAOYSA-N
XLogP2.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-(cyclopropylmethoxy)benzoyl]amino]acetic acid
CID 66812671
4-(cyclopropylmethoxy)-N-[(2R)-2-(ethylamino)propyl]benzamide;hydrochloride
CID 120654846
4-(cyclopropylmethoxy)-N-ethoxybenzamide
CID 60572474
2-[[4-(cyclopropylmethoxy)benzoyl]amino]butanoic acid
CID 119223456
4-(cyclopropylmethoxy)-N-(3-hydroxy-4-methylpentyl)benzamide
CID 111461405
N-ethyl-4-(2-methoxyethoxy)benzamide
CID 15943034
[[4-(cyclopentylmethoxy)benzoyl]amino]methanesulfinic acid
CID 174758918
4-(cyclopropylmethoxy)-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119439579
N-[[4-[(4-methoxyphenoxy)methyl]cyclohexyl]methyl]-4-phenylmethoxybenzamide
CID 58923644
N-(3-anilinopropyl)-4-(cyclopropylmethoxy)benzamide
CID 56541657
4-[[4-(cyclopropylmethoxy)benzoyl]amino]benzamide
CID 60571619
4-(cyclopropylmethoxy)-N-[2-[(R)-phenylsulfinyl]ethyl]benzamide
CID 95618513

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxy)-N-ethylbenzamide?
The IUPAC name of 4-(cyclopropylmethoxy)-N-ethylbenzamide (CID 60572461) is 4-(cyclopropylmethoxy)-N-ethylbenzamide.
What is the SMILES notation for 4-(cyclopropylmethoxy)-N-ethylbenzamide?
The canonical SMILES for 4-(cyclopropylmethoxy)-N-ethylbenzamide is CCNC(=O)c1ccc(OCC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylmethoxy)-N-ethylbenzamide?
The InChIKey is AOSUMXKPIMBOAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-2-14-13(15)11-5-7-12(8-6-11)16-9-10-3-4-10/h5-8,10H,2-4,9H2,1H3,(H,14,15).
What are the key properties of 4-(cyclopropylmethoxy)-N-ethylbenzamide?
4-(cyclopropylmethoxy)-N-ethylbenzamide has a molecular weight of 219.28 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxy)-N-ethylbenzamide is sourced from PubChem (CID 60572461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).