2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide

C16H25N3O2 — CID 62073465

IUPAC2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
SMILESCc1ccc(N)c(C(=O)NCC(C)(C)N2CCOCC2)c1
InChIInChI=1S/C16H25N3O2/c1-12-4-5-14(17)13(10-12)15(20)18-11-16(2,3)19-6-8-21-9-7-19/h4-5,10H,6-9,11,17H2,1-3H3,(H,18,20)
InChIKeyBFRRLFAORANFHR-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.42
Rot. Bonds4

About 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide

2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide (PubChem CID 62073465) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide.

Molecular Properties

Compound Name2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
PubChem CID62073465
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
SMILESCc1ccc(N)c(C(=O)NCC(C)(C)N2CCOCC2)c1
InChIInChI=1S/C16H25N3O2/c1-12-4-5-14(17)13(10-12)15(20)18-11-16(2,3)19-6-8-21-9-7-19/h4-5,10H,6-9,11,17H2,1-3H3,(H,18,20)
InChIKeyBFRRLFAORANFHR-UHFFFAOYSA-N
XLogP1.42
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.42
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

2,5-dibromo-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 114371891
2,5-dimethyl-N-(2-methyl-2-morpholin-4-ylpropyl)-1-(3-methylphenyl)pyrrole-3-carboxamide
CID 55348072
4-(2,5-dimethylphenyl)-N-(2-methyl-2-morpholin-4-ylpropyl)-4-oxobutanamide
CID 51163396
2,5-dimethoxy-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 51175190
4-amino-5-chloro-2-methoxy-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 119830234
4-tert-butyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 51163379
2-amino-5-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63707297
1-hydroxy-N-(2-methyl-2-morpholin-4-ylpropyl)naphthalene-2-carboxamide
CID 47011963
2-amino-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-5-methylbenzamide
CID 106274732
3-bromo-5-fluoro-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 46470982
2-ethoxy-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 51173152
N-(2-methyl-2-morpholin-4-ylpropyl)quinoline-8-carboxamide
CID 17459698

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The IUPAC name of 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide (CID 62073465) is 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide.
What is the SMILES notation for 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The canonical SMILES for 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide is Cc1ccc(N)c(C(=O)NCC(C)(C)N2CCOCC2)c1.
What is the InChIKey of 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
The InChIKey is BFRRLFAORANFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12-4-5-14(17)13(10-12)15(20)18-11-16(2,3)19-6-8-21-9-7-19/h4-5,10H,6-9,11,17H2,1-3H3,(H,18,20).
What are the key properties of 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide?
2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide has a molecular weight of 291.39 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide is sourced from PubChem (CID 62073465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).