N-hydroxy-6-(quinazolin-4-ylamino)hexanamide

C14H18N4O2 — CID 72545681

IUPACN-hydroxy-6-(quinazolin-4-ylamino)hexanamide
SMILESO=C(CCCCCNc1ncnc2ccccc12)NO
InChIInChI=1S/C14H18N4O2/c19-13(18-20)8-2-1-5-9-15-14-11-6-3-4-7-12(11)16-10-17-14/h3-4,6-7,10,20H,1-2,5,8-9H2,(H,18,19)(H,15,16,17)
InChIKeyDLOYVSYVEONZMS-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.11
Rot. Bonds7

About N-hydroxy-6-(quinazolin-4-ylamino)hexanamide

N-hydroxy-6-(quinazolin-4-ylamino)hexanamide (PubChem CID 72545681) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-hydroxy-6-(quinazolin-4-ylamino)hexanamide.

Molecular Properties

Compound NameN-hydroxy-6-(quinazolin-4-ylamino)hexanamide
PubChem CID72545681
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-hydroxy-6-(quinazolin-4-ylamino)hexanamide
SMILESO=C(CCCCCNc1ncnc2ccccc12)NO
InChIInChI=1S/C14H18N4O2/c19-13(18-20)8-2-1-5-9-15-14-11-6-3-4-7-12(11)16-10-17-14/h3-4,6-7,10,20H,1-2,5,8-9H2,(H,18,19)(H,15,16,17)
InChIKeyDLOYVSYVEONZMS-UHFFFAOYSA-N
XLogP2.11
TPSA87.14 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-Aminoquinazoline
CID 84759
N-(4-m-Tolylamino-quinazolin-6-yl)-acrylamide
CID 9995195
N-(4-Phenylamino-quinazolin-6-YL)-acrylamide
CID 10401956
4-Anilinoquinazoline
CID 324081
N-Benzylquinazolin-4-amine
CID 616573
N-(2-phenylethyl)quinazolin-4-amine
CID 198909
N-Cyclohexylquinazolin-4-amine
CID 13231190
4-(4-Acetyl-1-piperazinyl)quinazoline
CID 594152
KF 15232
CID 130152
N-methylquinazolin-4-amine
CID 252220
N-[4-(benzylamino)pyrido[4,3-d]pyrimidin-7-yl]acetamide
CID 5328248
N-(4-m-Tolylamino-quinazolin-7-yl)-acrylamide
CID 10494722

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-6-(quinazolin-4-ylamino)hexanamide?
The IUPAC name of N-hydroxy-6-(quinazolin-4-ylamino)hexanamide (CID 72545681) is N-hydroxy-6-(quinazolin-4-ylamino)hexanamide.
What is the SMILES notation for N-hydroxy-6-(quinazolin-4-ylamino)hexanamide?
The canonical SMILES for N-hydroxy-6-(quinazolin-4-ylamino)hexanamide is O=C(CCCCCNc1ncnc2ccccc12)NO.
What is the InChIKey of N-hydroxy-6-(quinazolin-4-ylamino)hexanamide?
The InChIKey is DLOYVSYVEONZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c19-13(18-20)8-2-1-5-9-15-14-11-6-3-4-7-12(11)16-10-17-14/h3-4,6-7,10,20H,1-2,5,8-9H2,(H,18,19)(H,15,16,17).
What are the key properties of N-hydroxy-6-(quinazolin-4-ylamino)hexanamide?
N-hydroxy-6-(quinazolin-4-ylamino)hexanamide has a molecular weight of 274.32 g/mol, XLogP of 2.11, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-6-(quinazolin-4-ylamino)hexanamide is sourced from PubChem (CID 72545681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).