N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide

C15H24N2O — CID 43275967

IUPACN-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide
SMILESCC(C)N(C(=O)C(C)(C)C)c1ccc(CN)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)17(14(18)15(3,4)5)13-8-6-12(10-16)7-9-13/h6-9,11H,10,16H2,1-5H3
InChIKeyCGEIDYAGLLLLRT-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.93
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide

N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide (PubChem CID 43275967) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide
PubChem CID43275967
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide
SMILESCC(C)N(C(=O)C(C)(C)C)c1ccc(CN)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)17(14(18)15(3,4)5)13-8-6-12(10-16)7-9-13/h6-9,11H,10,16H2,1-5H3
InChIKeyCGEIDYAGLLLLRT-UHFFFAOYSA-N
XLogP2.93
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(aminomethyl)phenyl]-N-propan-2-ylacetamide
CID 43275962
N-[4-(aminomethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]-N-propan-2-ylacetamide
CID 115949136
1-[4-(aminomethyl)phenyl]-1,3-di(propan-2-yl)urea
CID 43276091
N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide
CID 43275980
N-[4-(aminomethyl)phenyl]-2-cyclopropyl-N-propan-2-ylpropanamide
CID 83146456
N-[4-(aminomethyl)phenyl]-N-propan-2-ylmorpholine-4-carboxamide
CID 79155841
N-[4-(aminomethyl)phenyl]-N-propan-2-yloxane-4-carboxamide
CID 62907547
N-[4-(aminomethyl)phenyl]-N-propan-2-ylpyridine-3-carboxamide
CID 43276007
N-[4-(aminomethyl)phenyl]-5-methyl-N-propan-2-ylfuran-3-carboxamide
CID 114818480
N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide
CID 174490101
N-[4-(aminomethyl)phenyl]-3-methyl-N-propan-2-ylimidazole-4-carboxamide
CID 103510202
N-[4-(aminomethyl)phenyl]-N,2-dimethylpropanamide
CID 28755580

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide (CID 43275967) is N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide is CC(C)N(C(=O)C(C)(C)C)c1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide?
The InChIKey is CGEIDYAGLLLLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)17(14(18)15(3,4)5)13-8-6-12(10-16)7-9-13/h6-9,11H,10,16H2,1-5H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide?
N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide has a molecular weight of 248.37 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 43275967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).