N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide

C16H24N2O2 — CID 103339638

IUPACN-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide
SMILESC=CCN(CCOC)C(=O)c1ccccc1NCCC
InChIInChI=1S/C16H24N2O2/c1-4-10-17-15-9-7-6-8-14(15)16(19)18(11-5-2)12-13-20-3/h5-9,17H,2,4,10-13H2,1,3H3
InChIKeyBVUMJRQMGJSEON-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.78
Rot. Bonds9

About N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide

N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide (PubChem CID 103339638) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide
PubChem CID103339638
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide
SMILESC=CCN(CCOC)C(=O)c1ccccc1NCCC
InChIInChI=1S/C16H24N2O2/c1-4-10-17-15-9-7-6-8-14(15)16(19)18(11-5-2)12-13-20-3/h5-9,17H,2,4,10-13H2,1,3H3
InChIKeyBVUMJRQMGJSEON-UHFFFAOYSA-N
XLogP2.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(ethylamino)-N-(2-methoxyethyl)-N-prop-2-enylbenzamide
CID 103339639
N-ethyl-N-(2-methoxyethyl)-2-(propylamino)benzamide
CID 55047435
N-propan-2-yl-N-prop-2-enyl-2-(propylamino)benzamide
CID 63108031
N,N-diethyl-2-(propylamino)benzamide
CID 62171276
2-chloro-N-(2-methoxyethyl)-N-prop-2-enylpyridine-3-carboxamide
CID 103338613
N,N-bis(2-methoxyethyl)-4-(propylamino)pyridine-3-carboxamide
CID 81237784
N-(1-methoxypropan-2-yl)-N-methyl-2-(propylamino)benzamide
CID 62180129
N-(2-methoxyethyl)-N-prop-2-enylthiophene-2-carboxamide
CID 103340492
2-hydroxy-5-methoxy-N-(2-methoxyethyl)-N-prop-2-enylbenzamide
CID 103339084
3-ethyl-1-(2-methoxyethyl)-1-prop-2-enylurea
CID 103338592
5-bromo-2-iodo-N-(2-methoxyethyl)-N-prop-2-enylbenzamide
CID 103528752
N-methyl-N-propan-2-yl-2-(propylamino)benzamide
CID 62166178

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide?
The IUPAC name of N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide (CID 103339638) is N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide?
The canonical SMILES for N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide is C=CCN(CCOC)C(=O)c1ccccc1NCCC.
What is the InChIKey of N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide?
The InChIKey is BVUMJRQMGJSEON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-10-17-15-9-7-6-8-14(15)16(19)18(11-5-2)12-13-20-3/h5-9,17H,2,4,10-13H2,1,3H3.
What are the key properties of N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide?
N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.78, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-prop-2-enyl-2-(propylamino)benzamide is sourced from PubChem (CID 103339638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).