N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide

C11H17N3O — CID 174490101

IUPACN-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide
SMILESCC(C)C(=O)N(N)c1ccc(CN)cc1
InChIInChI=1S/C11H17N3O/c1-8(2)11(15)14(13)10-5-3-9(7-12)4-6-10/h3-6,8H,7,12-13H2,1-2H3
InChIKeyOZDLROISGXHALM-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.01
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide

N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide (PubChem CID 174490101) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide
PubChem CID174490101
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide
SMILESCC(C)C(=O)N(N)c1ccc(CN)cc1
InChIInChI=1S/C11H17N3O/c1-8(2)11(15)14(13)10-5-3-9(7-12)4-6-10/h3-6,8H,7,12-13H2,1-2H3
InChIKeyOZDLROISGXHALM-UHFFFAOYSA-N
XLogP1.01
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-(aminomethyl)phenyl]-N,2-dimethylpropanamide
CID 28755580
N-[[4-(aminomethyl)phenyl]methyl]-N,2-dimethylpropanamide
CID 60921311
N-[4-(aminomethyl)phenyl]-N-propan-2-ylacetamide
CID 43275962
N-[4-(aminomethyl)phenyl]-2-phenyl-N-propan-2-ylacetamide
CID 43275980
[4-(aminomethyl)phenyl]methyl 2-methylpropanoate
CID 166101467
N-[4-(aminomethyl)phenyl]-2,2-dimethyl-N-propan-2-ylpropanamide
CID 43275967
N-[4-(aminomethyl)phenyl]-2-cyclopropyl-N-propan-2-ylpropanamide
CID 83146456
N-(2-aminoethyl)-N-(4-ethylphenyl)-2-methylpropanamide
CID 28770054
N-[[3-(aminomethyl)phenyl]methyl]-N,2-dimethylpropanamide
CID 43248598
1-[4-(aminomethyl)phenyl]-1,3-di(propan-2-yl)urea
CID 43276091
1-[4-(aminomethyl)phenyl]-3-[4-(dimethylamino)phenyl]urea
CID 43617199
N-[4-(aminomethyl)phenyl]-N,2-dipropylpentanamide
CID 82984391

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide (CID 174490101) is N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide is CC(C)C(=O)N(N)c1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide?
The InChIKey is OZDLROISGXHALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8(2)11(15)14(13)10-5-3-9(7-12)4-6-10/h3-6,8H,7,12-13H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide?
N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide has a molecular weight of 207.28 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-methylpropanehydrazide is sourced from PubChem (CID 174490101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).