N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide

C13H18N2O2 — CID 62665285

IUPACN-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCCNC1CC1
InChIInChI=1S/C13H18N2O2/c1-17-12-5-3-2-4-11(12)13(16)15-9-8-14-10-6-7-10/h2-5,10,14H,6-9H2,1H3,(H,15,16)
InChIKeyRYSOAIPYFWOALP-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.18
Rot. Bonds6

About N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide

N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide (PubChem CID 62665285) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
PubChem CID62665285
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCCNC1CC1
InChIInChI=1S/C13H18N2O2/c1-17-12-5-3-2-4-11(12)13(16)15-9-8-14-10-6-7-10/h2-5,10,14H,6-9H2,1H3,(H,15,16)
InChIKeyRYSOAIPYFWOALP-UHFFFAOYSA-N
XLogP1.18
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cycloheptylamino)ethyl]-2-methoxybenzamide
CID 81487134
2-methoxy-N-[4-(propylamino)cyclohexyl]benzamide
CID 43653454
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
N-[2-(cyclopropylamino)ethyl]-2-methylbenzamide
CID 62663478
2,6-dimethoxy-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538022
2-hydroxy-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538036
N-[2-(cycloheptylamino)ethyl]-2-ethoxybenzamide;hydrochloride
CID 119620937
ethyl 4-[2-[(2-methoxybenzoyl)amino]ethylamino]piperidine-1-carboxylate;2,2,2-trifluoroacetic acid
CID 25010852
N-[2-[(2-chlorobenzoyl)amino]ethyl]-2-methoxybenzamide
CID 40718510
1-[2-(cyclopropylamino)ethyl]-3-(2-methoxyphenyl)urea
CID 55100972
N-[2-[(2-chloroacetyl)amino]ethyl]-2-methoxybenzamide
CID 108570753
N-[2-(cycloheptylamino)ethyl]-2-fluoro-6-methoxybenzamide
CID 119619869

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide?
The IUPAC name of N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide (CID 62665285) is N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide is COc1ccccc1C(=O)NCCNC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide?
The InChIKey is RYSOAIPYFWOALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-17-12-5-3-2-4-11(12)13(16)15-9-8-14-10-6-7-10/h2-5,10,14H,6-9H2,1H3,(H,15,16).
What are the key properties of N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide?
N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide has a molecular weight of 234.30 g/mol, XLogP of 1.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide is sourced from PubChem (CID 62665285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).