1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine

C18H17N3 — CID 106895014

IUPAC1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine
SMILESc1ccc(C(NCc2cccnn2)c2ccccc2)cc1
InChIInChI=1S/C18H17N3/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-21-17/h1-13,18-19H,14H2
InChIKeyKHAHLYZNKUVXLS-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.36
Rot. Bonds5

About 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine

1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine (PubChem CID 106895014) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine
PubChem CID106895014
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine
SMILESc1ccc(C(NCc2cccnn2)c2ccccc2)cc1
InChIInChI=1S/C18H17N3/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-21-17/h1-13,18-19H,14H2
InChIKeyKHAHLYZNKUVXLS-UHFFFAOYSA-N
XLogP3.36
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,3,3-trifluoro-1-phenyl-N-(pyridazin-3-ylmethyl)propan-1-amine
CID 106895245
(1R)-1-phenyl-3-(pyridazin-3-ylmethylamino)propan-1-ol
CID 112742140
4-[1-(pyridazin-3-ylmethylamino)ethyl]phenol
CID 106895349
N-(pyridazin-3-ylmethyl)benzenesulfonamide
CID 106833682
3-amino-3-phenyl-N-(pyridazin-3-ylmethyl)propanamide
CID 106896210
1-(3-methoxyphenyl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895169
N,N'-dibenzhydrylethane-1,2-diamine dichloride
CID 51371244
1-(1,3-benzothiazol-2-yl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895025
1-(5-chlorothiophen-2-yl)-N-(pyridazin-3-ylmethyl)-1-thiophen-2-ylmethanamine
CID 106895048
1-(2,3-dichlorophenyl)-N-(pyridazin-3-ylmethyl)ethanamine
CID 107094366
N-(pyridazin-3-ylmethyl)heptan-2-amine
CID 106895304
N-(pyridazin-3-ylmethyl)formamide
CID 23498776

Frequently Asked Questions

What is the IUPAC name of 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine?
The IUPAC name of 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine (CID 106895014) is 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine.
What is the SMILES notation for 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine?
The canonical SMILES for 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine is c1ccc(C(NCc2cccnn2)c2ccccc2)cc1.
What is the InChIKey of 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine?
The InChIKey is KHAHLYZNKUVXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-3-8-15(9-4-1)18(16-10-5-2-6-11-16)19-14-17-12-7-13-20-21-17/h1-13,18-19H,14H2.
What are the key properties of 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine?
1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine has a molecular weight of 275.36 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine is sourced from PubChem (CID 106895014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).