3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide

C15H24N2O — CID 115153583

IUPAC3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide
SMILESCc1ccc(C(C)C)cc1N(C)C(=O)C(C)CN
InChIInChI=1S/C15H24N2O/c1-10(2)13-7-6-11(3)14(8-13)17(5)15(18)12(4)9-16/h6-8,10,12H,9,16H2,1-5H3
InChIKeyQBXUPFLAKUVZKP-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.68
Rot. Bonds4

About 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide

3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide (PubChem CID 115153583) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide
PubChem CID115153583
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide
SMILESCc1ccc(C(C)C)cc1N(C)C(=O)C(C)CN
InChIInChI=1S/C15H24N2O/c1-10(2)13-7-6-11(3)14(8-13)17(5)15(18)12(4)9-16/h6-8,10,12H,9,16H2,1-5H3
InChIKeyQBXUPFLAKUVZKP-UHFFFAOYSA-N
XLogP2.68
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2-hydroxy-N-methyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide
CID 115180425
2-amino-3-hydroxy-N-methyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide
CID 115179748
3-amino-N,2-dimethyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propanamide
CID 115153748
2-chloro-N-methyl-N-(2-methyl-5-propan-2-ylphenyl)acetamide
CID 115161925
3-amino-N-methyl-N-(2-methyl-5-propan-2-ylphenyl)butanamide
CID 115154101
3-amino-N-(3,4-dimethylphenyl)-N,2-dimethylpropanamide
CID 83535959
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)-4-oxopentanamide
CID 115176806
3-amino-N,2-dimethyl-N-[(4-propan-2-ylphenyl)methyl]propanamide
CID 62671042
N-(chloromethyl)-N,2-dimethyl-5-propan-2-ylaniline
CID 115262883
2-amino-N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propanamide
CID 115152451
3-amino-N-(5-bromo-2-methoxyphenyl)-N,2-dimethylpropanamide
CID 115153548
(2-methyl-5-propan-2-ylphenyl) 2-aminoacetate;hydrochloride
CID 140833472

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide?
The IUPAC name of 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide (CID 115153583) is 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide?
The canonical SMILES for 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide is Cc1ccc(C(C)C)cc1N(C)C(=O)C(C)CN.
What is the InChIKey of 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide?
The InChIKey is QBXUPFLAKUVZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)13-7-6-11(3)14(8-13)17(5)15(18)12(4)9-16/h6-8,10,12H,9,16H2,1-5H3.
What are the key properties of 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide?
3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,2-dimethyl-N-(2-methyl-5-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 115153583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).