2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide

C15H20N2O3 — CID 61118260

IUPAC2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1cc(OC)c(OC)cc1N
InChIInChI=1S/C15H20N2O3/c1-5-7-17(8-6-2)15(18)11-9-13(19-3)14(20-4)10-12(11)16/h5-6,9-10H,1-2,7-8,16H2,3-4H3
InChIKeyUOJNIZBBLROVOR-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.10
Rot. Bonds7

About 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide

2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide (PubChem CID 61118260) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide.

Molecular Properties

Compound Name2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide
PubChem CID61118260
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide
SMILESC=CCN(CC=C)C(=O)c1cc(OC)c(OC)cc1N
InChIInChI=1S/C15H20N2O3/c1-5-7-17(8-6-2)15(18)11-9-13(19-3)14(20-4)10-12(11)16/h5-6,9-10H,1-2,7-8,16H2,3-4H3
InChIKeyUOJNIZBBLROVOR-UHFFFAOYSA-N
XLogP2.10
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N,N-diethyl-4,5-dimethoxybenzamide
CID 16776188
prop-2-enyl 2-amino-4,5-dimethoxybenzoate
CID 19432548
2-amino-4,5-dimethoxy-N-methylbenzohydrazide
CID 145124941
2-amino-3,5-dimethoxy-N-(2-methoxyethyl)-N-prop-2-enylbenzamide
CID 103338349
5-amino-2-methyl-N,N-bis(prop-2-enyl)benzamide
CID 61291356
2-(3,4-dimethoxyphenyl)-N,N-bis(prop-2-enyl)acetamide
CID 720349
2-amino-N-[3-(dimethylamino)propyl]-4,5-dimethoxy-N-methylbenzamide
CID 63695458
3-methoxy-4-propan-2-yloxy-N,N-bis(prop-2-enyl)benzamide
CID 78784416
2-bromo-5-methoxy-N,N-bis(prop-2-enyl)benzamide
CID 60636105
5-amino-2,4-dimethyl-N-prop-2-enyl-N-propylbenzamide
CID 102705822
2-amino-N-cyclopropyl-N-ethyl-4,5-dimethoxybenzamide
CID 43263713
1-(2-amino-4,5-dimethoxyphenyl)propan-1-one
CID 7148511

Frequently Asked Questions

What is the IUPAC name of 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide?
The IUPAC name of 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide (CID 61118260) is 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide.
What is the SMILES notation for 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide?
The canonical SMILES for 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide is C=CCN(CC=C)C(=O)c1cc(OC)c(OC)cc1N.
What is the InChIKey of 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide?
The InChIKey is UOJNIZBBLROVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-5-7-17(8-6-2)15(18)11-9-13(19-3)14(20-4)10-12(11)16/h5-6,9-10H,1-2,7-8,16H2,3-4H3.
What are the key properties of 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide?
2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide has a molecular weight of 276.34 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4,5-dimethoxy-N,N-bis(prop-2-enyl)benzamide is sourced from PubChem (CID 61118260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).