N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide

C16H18N4O — CID 113038827

IUPACN-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
SMILESO=C(Nc1ccc(NC2CCCC2)nn1)c1ccccc1
InChIInChI=1S/C16H18N4O/c21-16(12-6-2-1-3-7-12)18-15-11-10-14(19-20-15)17-13-8-4-5-9-13/h1-3,6-7,10-11,13H,4-5,8-9H2,(H,17,19)(H,18,20,21)
InChIKeyNFDKZPTWJPMQQK-UHFFFAOYSA-N
MW282.35 g/mol
LogP3.08
Rot. Bonds4

About N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide

N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide (PubChem CID 113038827) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide.

Molecular Properties

Compound NameN-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
PubChem CID113038827
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC NameN-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
SMILESO=C(Nc1ccc(NC2CCCC2)nn1)c1ccccc1
InChIInChI=1S/C16H18N4O/c21-16(12-6-2-1-3-7-12)18-15-11-10-14(19-20-15)17-13-8-4-5-9-13/h1-3,6-7,10-11,13H,4-5,8-9H2,(H,17,19)(H,18,20,21)
InChIKeyNFDKZPTWJPMQQK-UHFFFAOYSA-N
XLogP3.08
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(cycloheptylamino)pyridazin-3-yl]-4-methylbenzamide
CID 113044373
3-chloro-N-[6-(cycloheptylamino)pyridazin-3-yl]benzamide
CID 113044397
3-bromo-N-[6-(cycloheptylamino)pyridazin-3-yl]benzamide
CID 113044378
2-chloro-N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
CID 113038860
1-[6-(cyclopentylamino)pyridazin-3-yl]-3-phenylurea
CID 113038878
4-bromo-N-[6-(cyclopropylamino)pyridazin-3-yl]benzamide
CID 113038059
N-[6-(cyclopropylamino)pyridazin-3-yl]-4-methylbenzamide
CID 113038053
N-[6-(cyclopentylamino)pyridazin-3-yl]-2,2-diphenylacetamide
CID 113038844
4-tert-butyl-N-[6-(cyclopropylamino)pyridazin-3-yl]benzamide
CID 113038068
6-(cycloheptylamino)-N-phenylpyridazine-3-carboxamide
CID 109124960
N-[6-(cyclopropylamino)pyridazin-3-yl]-4-(trifluoromethyl)benzamide
CID 113038098
N-[6-(cycloheptylamino)pyridazin-3-yl]-2,6-dimethoxybenzamide
CID 113044384

Frequently Asked Questions

What is the IUPAC name of N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide?
The IUPAC name of N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide (CID 113038827) is N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide.
What is the SMILES notation for N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide?
The canonical SMILES for N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide is O=C(Nc1ccc(NC2CCCC2)nn1)c1ccccc1.
What is the InChIKey of N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide?
The InChIKey is NFDKZPTWJPMQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c21-16(12-6-2-1-3-7-12)18-15-11-10-14(19-20-15)17-13-8-4-5-9-13/h1-3,6-7,10-11,13H,4-5,8-9H2,(H,17,19)(H,18,20,21).
What are the key properties of N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide?
N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide has a molecular weight of 282.35 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide is sourced from PubChem (CID 113038827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).