N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine

C14H21N5 — CID 80917863

IUPACN-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine
SMILESCC(C)C(C)CNc1nc(NN)nc2ccccc12
InChIInChI=1S/C14H21N5/c1-9(2)10(3)8-16-13-11-6-4-5-7-12(11)17-14(18-13)19-15/h4-7,9-10H,8,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyVMELLERGDBZIBL-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.62
Rot. Bonds5

About N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine

N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine (PubChem CID 80917863) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine
PubChem CID80917863
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine
SMILESCC(C)C(C)CNc1nc(NN)nc2ccccc12
InChIInChI=1S/C14H21N5/c1-9(2)10(3)8-16-13-11-6-4-5-7-12(11)17-14(18-13)19-15/h4-7,9-10H,8,15H2,1-3H3,(H2,16,17,18,19)
InChIKeyVMELLERGDBZIBL-UHFFFAOYSA-N
XLogP2.62
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-hydrazinyl-N-(3-methyl-2-propan-2-ylbutyl)quinazolin-4-amine
CID 102908996
4-[(2-hydrazinylquinazolin-4-yl)amino]-3-methylbutan-1-ol
CID 80922127
2-hydrazinyl-N-(3-methylbutan-2-yl)quinazolin-4-amine
CID 80916847
3-[(2-hydrazinylquinazolin-4-yl)amino]-2-hydroxypropanamide
CID 114154625
N-(2-ethylhexyl)-2-hydrazinylquinazolin-4-amine
CID 107819198
N-butan-2-yl-2-hydrazinylquinazolin-4-amine
CID 80932741
2-N-methyl-4-N-(2-methylpropyl)quinazoline-2,4-diamine
CID 80770166
4-[(2-hydrazinylquinazolin-4-yl)amino]butan-1-ol
CID 106847076
N-[(4-bromophenyl)methyl]-2-hydrazinylquinazolin-4-amine
CID 80912063
N',N'-diethyl-N-(2-hydrazinylquinazolin-4-yl)propane-1,3-diamine
CID 80938208
N-(1-ethoxypropan-2-yl)-2-hydrazinylquinazolin-4-amine
CID 80902618
2-hydrazinyl-N-(4-methoxybutan-2-yl)quinazolin-4-amine
CID 80914929

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine?
The IUPAC name of N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine (CID 80917863) is N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine.
What is the SMILES notation for N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine?
The canonical SMILES for N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine is CC(C)C(C)CNc1nc(NN)nc2ccccc12.
What is the InChIKey of N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine?
The InChIKey is VMELLERGDBZIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-9(2)10(3)8-16-13-11-6-4-5-7-12(11)17-14(18-13)19-15/h4-7,9-10H,8,15H2,1-3H3,(H2,16,17,18,19).
What are the key properties of N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine?
N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine has a molecular weight of 259.36 g/mol, XLogP of 2.62, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutyl)-2-hydrazinylquinazolin-4-amine is sourced from PubChem (CID 80917863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).