N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide

C24H21N5O2 — CID 67375395

IUPACN-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
SMILESCc1ccc(-c2ccc(N)nn2)cc1NC(=O)c1ccc(OCc2ccccn2)cc1
InChIInChI=1S/C24H21N5O2/c1-16-5-6-18(21-11-12-23(25)29-28-21)14-22(16)27-24(30)17-7-9-20(10-8-17)31-15-19-4-2-3-13-26-19/h2-14H,15H2,1H3,(H2,25,29)(H,27,30)
InChIKeyUCIZAIFZGCLTCQ-UHFFFAOYSA-N
MW411.47 g/mol
LogP4.26
Rot. Bonds6

About N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide

N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide (PubChem CID 67375395) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
PubChem CID67375395
Molecular FormulaC24H21N5O2
Molecular Weight411.47 g/mol
Exact Mass411.17
IUPAC NameN-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
SMILESCc1ccc(-c2ccc(N)nn2)cc1NC(=O)c1ccc(OCc2ccccn2)cc1
InChIInChI=1S/C24H21N5O2/c1-16-5-6-18(21-11-12-23(25)29-28-21)14-22(16)27-24(30)17-7-9-20(10-8-17)31-15-19-4-2-3-13-26-19/h2-14H,15H2,1H3,(H2,25,29)(H,27,30)
InChIKeyUCIZAIFZGCLTCQ-UHFFFAOYSA-N
XLogP4.26
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-methyl-5-(3-morpholinobenzamido)phenyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 22291085
N-[2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]phenyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 70696850
N-[5-(5-amino-2-pyridinyl)-2,4-dimethylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 156019009
N-(2,4-dimethyl-5-pyridin-2-ylphenyl)-4-(pyridin-2-ylmethoxy)benzamide
CID 156019072
1-(3-Dimethylaminophenylcarboxamido)-4-methyl-3-[4-(2-pyridylmethoxy)phenylcarboxamido]benzene
CID 44395101
pyridin-3-ylmethyl N-[[4-[3-[[4-(2-morpholin-4-ylethoxy)benzoyl]amino]-1H-pyrazol-5-yl]phenyl]methyl]carbamate
CID 70654571
N-(2-methyl-5-pyridin-3-ylphenyl)-4-(pyridin-2-ylmethoxy)benzamide
CID 70688556
N-[2-methyl-5-(1,3,5-trimethylpyrazol-4-yl)phenyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 70692760
N-(2-methyl-5-pyridin-2-ylphenyl)-4-(pyridin-2-ylmethoxy)benzamide
CID 70694800
N-(2-methyl-5-pyridin-4-ylphenyl)-4-(pyridin-2-ylmethoxy)benzamide
CID 70694801
4-methoxy-N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]benzamide
CID 7422449
4-methoxy-N-[2-[2-(6-methoxy-3-pyridinyl)tetrazol-5-yl]phenyl]benzamide
CID 145975509

Frequently Asked Questions

What is the IUPAC name of N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide?
The IUPAC name of N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide (CID 67375395) is N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide.
What is the SMILES notation for N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide?
The canonical SMILES for N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide is Cc1ccc(-c2ccc(N)nn2)cc1NC(=O)c1ccc(OCc2ccccn2)cc1.
What is the InChIKey of N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide?
The InChIKey is UCIZAIFZGCLTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-16-5-6-18(21-11-12-23(25)29-28-21)14-22(16)27-24(30)17-7-9-20(10-8-17)31-15-19-4-2-3-13-26-19/h2-14H,15H2,1H3,(H2,25,29)(H,27,30).
What are the key properties of N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide?
N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide has a molecular weight of 411.47 g/mol, XLogP of 4.26, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(6-aminopyridazin-3-yl)-2-methylphenyl]-4-(pyridin-2-ylmethoxy)benzamide is sourced from PubChem (CID 67375395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).