N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide

C19H19BrN4 — CID 54762207

IUPACN-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide
SMILESBr.c1ccc(-c2cc(-c3ccncc3)c(NCC3CC3)nn2)cc1
InChIInChI=1S/C19H18N4.BrH/c1-2-4-16(5-3-1)18-12-17(15-8-10-20-11-9-15)19(23-22-18)21-13-14-6-7-14;/h1-5,8-12,14H,6-7,13H2,(H,21,23);1H
InChIKeyXXZIPMAEJXZXOJ-UHFFFAOYSA-N
MW383.29 g/mol
LogP4.61
Rot. Bonds5

About N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide

N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide (PubChem CID 54762207) has the molecular formula C19H19BrN4 and a molecular weight of 383.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide
PubChem CID54762207
Molecular FormulaC19H19BrN4
Molecular Weight383.29 g/mol
Exact Mass382.08
IUPAC NameN-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide
SMILESBr.c1ccc(-c2cc(-c3ccncc3)c(NCC3CC3)nn2)cc1
InChIInChI=1S/C19H18N4.BrH/c1-2-4-16(5-3-1)18-12-17(15-8-10-20-11-9-15)19(23-22-18)21-13-14-6-7-14;/h1-5,8-12,14H,6-7,13H2,(H,21,23);1H
InChIKeyXXZIPMAEJXZXOJ-UHFFFAOYSA-N
XLogP4.61
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.29
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide?
The IUPAC name of N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide (CID 54762207) is N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide.
What is the SMILES notation for N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide?
The canonical SMILES for N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide is Br.c1ccc(-c2cc(-c3ccncc3)c(NCC3CC3)nn2)cc1.
What is the InChIKey of N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide?
The InChIKey is XXZIPMAEJXZXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4.BrH/c1-2-4-16(5-3-1)18-12-17(15-8-10-20-11-9-15)19(23-22-18)21-13-14-6-7-14;/h1-5,8-12,14H,6-7,13H2,(H,21,23);1H.
What are the key properties of N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide?
N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide has a molecular weight of 383.29 g/mol, XLogP of 4.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-phenyl-4-pyridin-4-ylpyridazin-3-amine;hydrobromide is sourced from PubChem (CID 54762207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).