2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide

C15H24N2O3 — CID 115950600

IUPAC2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide
SMILESCCC(C)C(C)NC(=O)c1cc(OC)cc(OC)c1N
InChIInChI=1S/C15H24N2O3/c1-6-9(2)10(3)17-15(18)12-7-11(19-4)8-13(20-5)14(12)16/h7-10H,6,16H2,1-5H3,(H,17,18)
InChIKeyFCQNWUWXNXVMBS-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.45
Rot. Bonds6

About 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide

2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide (PubChem CID 115950600) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide.

Molecular Properties

Compound Name2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide
PubChem CID115950600
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide
SMILESCCC(C)C(C)NC(=O)c1cc(OC)cc(OC)c1N
InChIInChI=1S/C15H24N2O3/c1-6-9(2)10(3)17-15(18)12-7-11(19-4)8-13(20-5)14(12)16/h7-10H,6,16H2,1-5H3,(H,17,18)
InChIKeyFCQNWUWXNXVMBS-UHFFFAOYSA-N
XLogP2.45
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-3,5-dimethoxy-N-(2-methylpentan-3-yl)benzamide
CID 115950603
2-amino-N-(5-hydroxypentan-2-yl)-3,5-dimethoxybenzamide
CID 115950760
2-amino-N-ethyl-3,5-dimethoxybenzamide
CID 112606069
2-amino-N-[4-(dimethylamino)butan-2-yl]-3,5-dimethoxybenzamide
CID 115950608
2-amino-3,5-dimethoxy-N-(3-methylbutyl)benzamide
CID 112606081
4-amino-5-chloro-2-methoxy-N-(3-methylpentan-2-yl)benzamide
CID 119744569
2-amino-3,5-dimethoxy-N-(3-methylpentan-3-yl)benzamide
CID 106327779
2-amino-N-butyl-3,5-dimethoxybenzamide
CID 112606080
2-amino-N-(4-hydroxy-2-methylbutyl)-3,5-dimethoxybenzamide
CID 115950742
2-amino-N-(2-fluoroethyl)-3,5-dimethoxybenzamide
CID 114266909
(1-ethoxy-1-oxopropan-2-yl) 2-amino-3,5-dimethoxybenzoate
CID 115626344
(1-amino-1-oxobutan-2-yl) 2-amino-3,5-dimethoxybenzoate
CID 115605847

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide?
The IUPAC name of 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide (CID 115950600) is 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide.
What is the SMILES notation for 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide?
The canonical SMILES for 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide is CCC(C)C(C)NC(=O)c1cc(OC)cc(OC)c1N.
What is the InChIKey of 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide?
The InChIKey is FCQNWUWXNXVMBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-6-9(2)10(3)17-15(18)12-7-11(19-4)8-13(20-5)14(12)16/h7-10H,6,16H2,1-5H3,(H,17,18).
What are the key properties of 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide?
2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,5-dimethoxy-N-(3-methylpentan-2-yl)benzamide is sourced from PubChem (CID 115950600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).